3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide

C17H34N2O — CID 103966637

IUPAC3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
SMILESCC1(C)CC(NC(=O)CC(N)C(C)(C)C)CC(C)(C)C1
InChIInChI=1S/C17H34N2O/c1-15(2,3)13(18)8-14(20)19-12-9-16(4,5)11-17(6,7)10-12/h12-13H,8-11,18H2,1-7H3,(H,19,20)
InChIKeyZNLOSOWGZNLECM-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.47
Rot. Bonds3

About 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide

3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide (PubChem CID 103966637) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide.

Molecular Properties

Compound Name3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
PubChem CID103966637
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
SMILESCC1(C)CC(NC(=O)CC(N)C(C)(C)C)CC(C)(C)C1
InChIInChI=1S/C17H34N2O/c1-15(2,3)13(18)8-14(20)19-12-9-16(4,5)11-17(6,7)10-12/h12-13H,8-11,18H2,1-7H3,(H,19,20)
InChIKeyZNLOSOWGZNLECM-UHFFFAOYSA-N
XLogP3.47
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-4-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
CID 103966622
3-amino-4-oxo-4-[(3,3,5,5-tetramethylcyclohexyl)amino]butanoic acid
CID 103966570
3-oxo-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propanoic acid
CID 103968332
(2R)-2-amino-N-(3,3,5,5-tetramethylcyclohexyl)propanamide;hydrochloride
CID 120874151
3-amino-2,2-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)propanamide
CID 103966047
3-sulfanyl-N-(3,3,5,5-tetramethylcyclohexyl)propanamide
CID 107034267
2-amino-N-[2-oxo-2-[(3,3,5,5-tetramethylcyclohexyl)amino]ethyl]acetamide
CID 103966642
5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
CID 113359655
2-amino-4-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
CID 112639937
(2S,3S)-2-amino-3-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
CID 103951343
3-amino-N-[2-(hydroxymethyl)cyclopentyl]-4,4-dimethylpentanamide
CID 114178708
2-amino-N-(3,3,5,5-tetramethylcyclohexyl)hexanamide
CID 112639940

Frequently Asked Questions

What is the IUPAC name of 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
The IUPAC name of 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide (CID 103966637) is 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide.
What is the SMILES notation for 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
The canonical SMILES for 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide is CC1(C)CC(NC(=O)CC(N)C(C)(C)C)CC(C)(C)C1.
What is the InChIKey of 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
The InChIKey is ZNLOSOWGZNLECM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-15(2,3)13(18)8-14(20)19-12-9-16(4,5)11-17(6,7)10-12/h12-13H,8-11,18H2,1-7H3,(H,19,20).
What are the key properties of 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide has a molecular weight of 282.47 g/mol, XLogP of 3.47, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide is sourced from PubChem (CID 103966637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).