chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane

C237H436ClF3N6O4S3 — CID 158210102

About chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane

chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane (PubChem CID 158210102) has the molecular formula C237H436ClF3N6O4S3 and a molecular weight of 3622.78 g/mol. Its IUPAC name is chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane.

Molecular Properties

• Compound Name: chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane
• PubChem CID: 158210102
• Molecular Formula: C237H436ClF3N6O4S3
• Molecular Weight: 3622.78 g/mol
• Exact Mass: 3619.29
• IUPAC Name: chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane
• SMILES: CC.CC(C)(C)CC(C)(C)C.CC(C)(C)CC1CC1.CC(C)(C)CC1CCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)CCc1ccccc1.CC(C)(C)CN1CCCCC1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccco1.CC(C)(C)Cc1cccs1.CC(C)(C)Cc1ccoc1.CC(C)(C)Cc1ccsc1.CC(C)(C)Cc1ncco1.CC(C)(C)Cc1nccs1.CC(C)CC(C)(C)C.CC(C)CCC(C)(C)C.CCC(CC)CC(C)(C)C.CCN(CC)CC(C)(C)C.CCl.CF.CF.CF.CN(C)CC(C)(C)C.CN(C)CCC(C)(C)C.COC
• InChI: InChI=1S/C12H18.C11H22.6C11H16.C10H21N.C10H20.C10H22.C9H21N.2C9H14O.2C9H14S.2C9H20.C8H13NO.C8H13NS.C8H19N.C8H16.C8H18.C7H17N.C2H6O.C2H6.CH3Cl.3CH3F/c1-12(2,3)10-9-11-7-5-4-6-8-11;7*1-11(2,3)9-10-7-5-4-6-8-10;1-10(2,3)9-11-7-5-4-6-8-11;1-10(2,3)8-9-6-4-5-7-9;1-6-9(7-2)8-10(3,4)5;1-6-10(7-2)8-9(3,4)5;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-8(2,3)7-9(4,5)6;1-8(2)6-7-9(3,4)5;2*1-8(2,3)6-7-9-4-5-10-7;1-8(2,3)6-7-9(4)5;1-8(2,3)6-7-4-5-7;1-7(2)6-8(3,4)5;1-7(2,3)6-8(4)5;1-3-2;5*1-2/h4-8H,9-10H2,1-3H3;10H,4-9H2,1-3H3;6*4-8H,9H2,1-3H3;4-9H2,1-3H3;9H,4-8H2,1-3H3;9H,6-8H2,1-5H3;6-8H2,1-5H3;4-5,7H,6H2,1-3H3;4-6H,7H2,1-3H3;4-5,7H,6H2,1-3H3;4-6H,7H2,1-3H3;7H2,1-6H3;8H,6-7H2,1-5H3;2*4-5H,6H2,1-3H3;6-7H2,1-5H3;7H,4-6H2,1-3H3;7H,6H2,1-5H3;6H2,1-5H3;1-2H3;1-2H3;4*1H3
• InChIKey: GBYVJMJPAJNJSR-UHFFFAOYSA-N
• XLogP: 77.42
• TPSA: 87.39 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 30
• Heavy Atoms: 254
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3622.78
LogP ≤ 5	77.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane?

The IUPAC name of chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane (CID 158210102) is chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane.

What is the SMILES notation for chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane?

The canonical SMILES for chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane is CC.CC(C)(C)CC(C)(C)C.CC(C)(C)CC1CC1.CC(C)(C)CC1CCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)CCc1ccccc1.CC(C)(C)CN1CCCCC1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccccc1.CC(C)(C)Cc1ccco1.CC(C)(C)Cc1cccs1.CC(C)(C)Cc1ccoc1.CC(C)(C)Cc1ccsc1.CC(C)(C)Cc1ncco1.CC(C)(C)Cc1nccs1.CC(C)CC(C)(C)C.CC(C)CCC(C)(C)C.CCC(CC)CC(C)(C)C.CCN(CC)CC(C)(C)C.CCl.CF.CF.CF.CN(C)CC(C)(C)C.CN(C)CCC(C)(C)C.COC.

What is the InChIKey of chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane?

The InChIKey is GBYVJMJPAJNJSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18.C11H22.6C11H16.C10H21N.C10H20.C10H22.C9H21N.2C9H14O.2C9H14S.2C9H20.C8H13NO.C8H13NS.C8H19N.C8H16.C8H18.C7H17N.C2H6O.C2H6.CH3Cl.3CH3F/c1-12(2,3)10-9-11-7-5-4-6-8-11;7*1-11(2,3)9-10-7-5-4-6-8-10;1-10(2,3)9-11-7-5-4-6-8-11;1-10(2,3)8-9-6-4-5-7-9;1-6-9(7-2)8-10(3,4)5;1-6-10(7-2)8-9(3,4)5;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-9(2,3)6-8-4-5-10-7-8;1-9(2,3)7-8-5-4-6-10-8;1-8(2,3)7-9(4,5)6;1-8(2)6-7-9(3,4)5;2*1-8(2,3)6-7-9-4-5-10-7;1-8(2,3)6-7-9(4)5;1-8(2,3)6-7-4-5-7;1-7(2)6-8(3,4)5;1-7(2,3)6-8(4)5;1-3-2;5*1-2/h4-8H,9-10H2,1-3H3;10H,4-9H2,1-3H3;6*4-8H,9H2,1-3H3;4-9H2,1-3H3;9H,4-8H2,1-3H3;9H,6-8H2,1-5H3;6-8H2,1-5H3;4-5,7H,6H2,1-3H3;4-6H,7H2,1-3H3;4-5,7H,6H2,1-3H3;4-6H,7H2,1-3H3;7H2,1-6H3;8H,6-7H2,1-5H3;2*4-5H,6H2,1-3H3;6-7H2,1-5H3;7H,4-6H2,1-3H3;7H,6H2,1-5H3;6H2,1-5H3;1-2H3;1-2H3;4*1H3.

What are the key properties of chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane?

chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane has a molecular weight of 3622.78 g/mol, XLogP of 77.42, 30 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for chloromethane;N,N-diethyl-2,2-dimethylpropan-1-amine;3,3-dimethylbutylbenzene;hexakis(2,2-dimethylpropylbenzene);2,2-dimethylpropylcyclohexane;2,2-dimethylpropylcyclopentane;2,2-dimethylpropylcyclopropane;2-(2,2-dimethylpropyl)furan;3-(2,2-dimethylpropyl)furan;2-(2,2-dimethylpropyl)-1,3-oxazole;1-(2,2-dimethylpropyl)piperidine;2-(2,2-dimethylpropyl)-1,3-thiazole;2-(2,2-dimethylpropyl)thiophene;3-(2,2-dimethylpropyl)thiophene;ethane;4-ethyl-2,2-dimethylhexane;fluoromethane;methoxymethane;N,N,3,3-tetramethylbutan-1-amine;2,2,4,4-tetramethylpentane;N,N,2,2-tetramethylpropan-1-amine;2,2,5-trimethylhexane;2,2,4-trimethylpentane is sourced from PubChem (CID 158210102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).