N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide

C15H28N2O — CID 112681962

IUPACN-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide
SMILESCC1(C)CC(NCC(=O)NC2CC2)CC(C)(C)C1
InChIInChI=1S/C15H28N2O/c1-14(2)7-12(8-15(3,4)10-14)16-9-13(18)17-11-5-6-11/h11-12,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyBXGWIOBLZQQFGK-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.46
Rot. Bonds4

About N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide

N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide (PubChem CID 112681962) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide
PubChem CID112681962
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide
SMILESCC1(C)CC(NCC(=O)NC2CC2)CC(C)(C)C1
InChIInChI=1S/C15H28N2O/c1-14(2)7-12(8-15(3,4)10-14)16-9-13(18)17-11-5-6-11/h11-12,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyBXGWIOBLZQQFGK-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Diaethylaminoessigsaeure-cis,cis-2,6-dimethylcyclohexylamid [German]
CID 3044615
Acetamide, 2-(diethylamino)-N-(2,6-dimethylcyclohexyl)-, (1-alpha,2-alpha,6-beta)-
CID 3044616
N-(cyclopropylmethyl)-2-[(2-ethyl-2-methylcyclopentyl)amino]acetamide
CID 126835314
N-[(5-acetamido-1,3,3-trimethylcyclohexyl)methyl]acetamide
CID 4155081
2-[(4,4-dimethylcyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 64393312
2-[(3,5-dimethylcyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 64732677
N-(3,5-dimethylcyclohexyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78998688
N-(4,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79005768
2-[(2,2-dimethylcyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 79871046
N-(2,2-dimethylcyclohexyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79878374
2-[(3,3-dimethylcyclohexyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 81421759
N-(3,3-dimethylcyclohexyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 81564731

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide (CID 112681962) is N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide is CC1(C)CC(NCC(=O)NC2CC2)CC(C)(C)C1.
What is the InChIKey of N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide?
The InChIKey is BXGWIOBLZQQFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-14(2)7-12(8-15(3,4)10-14)16-9-13(18)17-11-5-6-11/h11-12,16H,5-10H2,1-4H3,(H,17,18).
What are the key properties of N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide?
N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide has a molecular weight of 252.40 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3,3,5,5-tetramethylcyclohexyl)amino]acetamide is sourced from PubChem (CID 112681962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).