2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide

C14H28N2O — CID 104830066

IUPAC2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide
SMILESCC(NC(=O)CC1CCC(N)CC1)C(C)(C)C
InChIInChI=1S/C14H28N2O/c1-10(14(2,3)4)16-13(17)9-11-5-7-12(15)8-6-11/h10-12H,5-9,15H2,1-4H3,(H,16,17)
InChIKeyLKXUUICHLOPQNA-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.44
Rot. Bonds3

About 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide

2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide (PubChem CID 104830066) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide
PubChem CID104830066
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide
SMILESCC(NC(=O)CC1CCC(N)CC1)C(C)(C)C
InChIInChI=1S/C14H28N2O/c1-10(14(2,3)4)16-13(17)9-11-5-7-12(15)8-6-11/h10-12H,5-9,15H2,1-4H3,(H,16,17)
InChIKeyLKXUUICHLOPQNA-UHFFFAOYSA-N
XLogP2.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777737
2-(4-aminocyclohexyl)-N-(2,3-dimethylbutyl)acetamide
CID 64583220
2-(4-aminocyclohexyl)-N-heptan-2-ylacetamide
CID 62781706
2-(4-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide
CID 64603111
2-(4-aminocyclohexyl)-N-(1-hydroxy-4-methylpentan-2-yl)acetamide
CID 62782742
2-[(2-cyclopropylacetyl)amino]-3,3-dimethylbutanoic acid
CID 43467501
2-cyclopropyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]acetamide
CID 79252136
2-amino-N-(3,3-dimethylbutan-2-yl)acetamide
CID 115733734
2-(4-aminocyclohexyl)-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 62782466
2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide
CID 174392631
tert-butyl (2R)-2-[(2-cyclopentylacetyl)amino]-3-methylbutanoate
CID 81003942
N-[(4-aminocyclohexyl)methyl]-3,4,4-trimethylpentanamide
CID 106124369

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide?
The IUPAC name of 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide (CID 104830066) is 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide?
The canonical SMILES for 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide is CC(NC(=O)CC1CCC(N)CC1)C(C)(C)C.
What is the InChIKey of 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide?
The InChIKey is LKXUUICHLOPQNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-10(14(2,3)4)16-13(17)9-11-5-7-12(15)8-6-11/h10-12H,5-9,15H2,1-4H3,(H,16,17).
What are the key properties of 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide?
2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide is sourced from PubChem (CID 104830066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).