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

C15H30N2O — CID 113359655

IUPAC5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
SMILESCC1(C)CC(NC(=O)CCCCN)CC(C)(C)C1
InChIInChI=1S/C15H30N2O/c1-14(2)9-12(10-15(3,4)11-14)17-13(18)7-5-6-8-16/h12H,5-11,16H2,1-4H3,(H,17,18)
InChIKeyGMVWMICQSBSVSY-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.84
Rot. Bonds5

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

5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide (PubChem CID 113359655) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide.

Molecular Properties

Compound Name5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
PubChem CID113359655
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
SMILESCC1(C)CC(NC(=O)CCCCN)CC(C)(C)C1
InChIInChI=1S/C15H30N2O/c1-14(2)9-12(10-15(3,4)11-14)17-13(18)7-5-6-8-16/h12H,5-11,16H2,1-4H3,(H,17,18)
InChIKeyGMVWMICQSBSVSY-UHFFFAOYSA-N
XLogP2.84
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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
3-oxo-3-[(3,3,5,5-tetramethylcyclohexyl)amino]propanoic acid
CID 103968332
5-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 114629795
N-(3,3-dimethylcyclopentyl)-5-hydroxypentanamide
CID 114541453
7-amino-N-(1-methylpiperidin-4-yl)heptanamide
CID 43373568
3-amino-4-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
CID 103966622
3-amino-2,2-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)propanamide
CID 103966047
3-amino-4,4-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide
CID 103966637
4-amino-N-(2,2,3,3-tetramethylcyclopropyl)butanamide
CID 79362190
7-amino-N-(3-methylcyclohexyl)heptanamide
CID 43317968
6-amino-N-(4-methylcycloheptyl)hexanamide
CID 114100037

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
The IUPAC name of 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide (CID 113359655) is 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide.
What is the SMILES notation for 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
The canonical SMILES for 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide is CC1(C)CC(NC(=O)CCCCN)CC(C)(C)C1.
What is the InChIKey of 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
The InChIKey is GMVWMICQSBSVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-14(2)9-12(10-15(3,4)11-14)17-13(18)7-5-6-8-16/h12H,5-11,16H2,1-4H3,(H,17,18).
What are the key properties of 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide?
5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide has a molecular weight of 254.42 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(3,3,5,5-tetramethylcyclohexyl)pentanamide is sourced from PubChem (CID 113359655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).