N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine

C137H302N20O8 — CID 158817879

About N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine

N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine (PubChem CID 158817879) has the molecular formula C137H302N20O8 and a molecular weight of 2358.05 g/mol. Its IUPAC name is N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine.

Molecular Properties

• Compound Name: N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine
• PubChem CID: 158817879
• Molecular Formula: C137H302N20O8
• Molecular Weight: 2358.05 g/mol
• Exact Mass: 2356.38
• IUPAC Name: N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine
• SMILES: CC(C)CC(=O)NCCCN1CCOCC1.CC(C)CCN1CCNCC1.CC(C)CCN1CCOCC1.CC(C)CCNC(C)C.CC(C)CN(C)C.CC(C)CN1CC(N2CCOCC2)C1.CC(C)CN1CC(O)C1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCN(CCO)CC1.CC(C)CN1C[C@@H](C)O[C@@H](C)C1.CCC(C)C.CCCC(C)C.CCCNCCC(C)C.CCN(CC)CCC(C)C.CCN1CCN(CC(C)C)CC1.COC1CN(CC(C)C)C1
• InChI: InChI=1S/C12H24N2O2.C11H22N2O.C10H22N2O.C10H22N2.C10H21NO.2C9H20N2.C9H19NO.C9H21N.C8H17NO.2C8H19N.C7H15NO.C6H15N.C6H14.C5H12/c1-11(2)10-12(15)13-4-3-5-14-6-8-16-9-7-14;1-10(2)7-12-8-11(9-12)13-3-5-14-6-4-13;1-10(2)9-12-5-3-11(4-6-12)7-8-13;1-4-11-5-7-12(8-6-11)9-10(2)3;1-8(2)5-11-6-9(3)12-10(4)7-11;1-9(2)8-11-6-4-10(3)5-7-11;1-9(2)3-6-11-7-4-10-5-8-11;1-9(2)3-4-10-5-7-11-8-6-10;1-5-10(6-2)8-7-9(3)4;1-7(2)4-9-5-8(6-9)10-3;1-7(2)5-6-9-8(3)4;1-4-6-9-7-5-8(2)3;1-6(2)3-8-4-7(9)5-8;1-6(2)5-7(3)4;1-4-5-6(2)3;1-4-5(2)3/h11H,3-10H2,1-2H3,(H,13,15);10-11H,3-9H2,1-2H3;10,13H,3-9H2,1-2H3;10H,4-9H2,1-3H3;8-10H,5-7H2,1-4H3;9H,4-8H2,1-3H3;9-10H,3-8H2,1-2H3;9H,3-8H2,1-2H3;9H,5-8H2,1-4H3;7-8H,4-6H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;6-7,9H,3-5H2,1-2H3;6H,5H2,1-4H3;6H,4-5H2,1-3H3;5H,4H2,1-3H3/t;;;;9-,10+
• InChIKey: IVMOAWWZVAGTFR-HDJWIXAPSA-N
• XLogP: 21.43
• TPSA: 203.64 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 50
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2358.05
LogP ≤ 5	21.43
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine?

The IUPAC name of N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine (CID 158817879) is N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine.

What is the SMILES notation for N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine?

The canonical SMILES for N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine is CC(C)CC(=O)NCCCN1CCOCC1.CC(C)CCN1CCNCC1.CC(C)CCN1CCOCC1.CC(C)CCNC(C)C.CC(C)CN(C)C.CC(C)CN1CC(N2CCOCC2)C1.CC(C)CN1CC(O)C1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCN(CCO)CC1.CC(C)CN1C[C@@H](C)O[C@@H](C)C1.CCC(C)C.CCCC(C)C.CCCNCCC(C)C.CCN(CC)CCC(C)C.CCN1CCN(CC(C)C)CC1.COC1CN(CC(C)C)C1.

What is the InChIKey of N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine?

The InChIKey is IVMOAWWZVAGTFR-HDJWIXAPSA-N. The full InChI is InChI=1S/C12H24N2O2.C11H22N2O.C10H22N2O.C10H22N2.C10H21NO.2C9H20N2.C9H19NO.C9H21N.C8H17NO.2C8H19N.C7H15NO.C6H15N.C6H14.C5H12/c1-11(2)10-12(15)13-4-3-5-14-6-8-16-9-7-14;1-10(2)7-12-8-11(9-12)13-3-5-14-6-4-13;1-10(2)9-12-5-3-11(4-6-12)7-8-13;1-4-11-5-7-12(8-6-11)9-10(2)3;1-8(2)5-11-6-9(3)12-10(4)7-11;1-9(2)8-11-6-4-10(3)5-7-11;1-9(2)3-6-11-7-4-10-5-8-11;1-9(2)3-4-10-5-7-11-8-6-10;1-5-10(6-2)8-7-9(3)4;1-7(2)4-9-5-8(6-9)10-3;1-7(2)5-6-9-8(3)4;1-4-6-9-7-5-8(2)3;1-6(2)3-8-4-7(9)5-8;1-6(2)5-7(3)4;1-4-5-6(2)3;1-4-5(2)3/h11H,3-10H2,1-2H3,(H,13,15);10-11H,3-9H2,1-2H3;10,13H,3-9H2,1-2H3;10H,4-9H2,1-3H3;8-10H,5-7H2,1-4H3;9H,4-8H2,1-3H3;9-10H,3-8H2,1-2H3;9H,3-8H2,1-2H3;9H,5-8H2,1-4H3;7-8H,4-6H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;6-7,9H,3-5H2,1-2H3;6H,5H2,1-4H3;6H,4-5H2,1-3H3;5H,4H2,1-3H3/t;;;;9-,10+;;;;;;;;;;;.

What are the key properties of N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine?

N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine has a molecular weight of 2358.05 g/mol, XLogP of 21.43, 50 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diethyl-3-methylbutan-1-amine;(2S,6R)-2,6-dimethyl-4-(2-methylpropyl)morpholine;1-ethyl-4-(2-methylpropyl)piperazine;3-methoxy-1-(2-methylpropyl)azetidine;2-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine;3-methyl-N-(3-morpholin-4-ylpropyl)butanamide;2-methylpentane;3-methyl-N-propan-2-ylbutan-1-amine;1-(2-methylpropyl)azetidin-3-ol;4-[1-(2-methylpropyl)azetidin-3-yl]morpholine;3-methyl-N-propylbutan-1-amine;2-[4-(2-methylpropyl)piperazin-1-yl]ethanol;N,N,2-trimethylpropan-1-amine is sourced from PubChem (CID 158817879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).