6-amino-N-(4-methylcycloheptyl)hexanamide

C14H28N2O — CID 114100037

IUPAC6-amino-N-(4-methylcycloheptyl)hexanamide
SMILESCC1CCCC(NC(=O)CCCCCN)CC1
InChIInChI=1S/C14H28N2O/c1-12-6-5-7-13(10-9-12)16-14(17)8-3-2-4-11-15/h12-13H,2-11,15H2,1H3,(H,16,17)
InChIKeyDIKKTOIAYQEWLF-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.59
Rot. Bonds6

About 6-amino-N-(4-methylcycloheptyl)hexanamide

6-amino-N-(4-methylcycloheptyl)hexanamide (PubChem CID 114100037) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 6-amino-N-(4-methylcycloheptyl)hexanamide.

Molecular Properties

Compound Name6-amino-N-(4-methylcycloheptyl)hexanamide
PubChem CID114100037
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name6-amino-N-(4-methylcycloheptyl)hexanamide
SMILESCC1CCCC(NC(=O)CCCCCN)CC1
InChIInChI=1S/C14H28N2O/c1-12-6-5-7-13(10-9-12)16-14(17)8-3-2-4-11-15/h12-13H,2-11,15H2,1H3,(H,16,17)
InChIKeyDIKKTOIAYQEWLF-UHFFFAOYSA-N
XLogP2.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.59
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

7-amino-N-(3-methylcyclohexyl)heptanamide
CID 43317968
N-cyclobutylhexadecanamide
CID 67041463
N-cyclobutylicosanamide
CID 10384249
7-amino-N-(4-butylcyclohexyl)heptanamide;hydrochloride
CID 119750320
4-(7-aminoheptanoylamino)cyclohexane-1-carboxylic acid
CID 61160664
N,N'-dicyclopropyldecanediamide
CID 4668836
7-amino-N-(1-methylpiperidin-4-yl)heptanamide
CID 43373568
N-cyclohexyltetradecanamide
CID 10244853
N-cycloheptylnonanamide
CID 5045141
7-amino-N-[4-(2-methylbutan-2-yl)cyclohexyl]heptanamide
CID 43698547
6-amino-N-(1-propylpiperidin-4-yl)hexanamide
CID 61276354
cis-(1R,3S)-3-(5-aminopentanoylamino)cyclopentane-1-carboxylic acid
CID 106322808

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(4-methylcycloheptyl)hexanamide?
The IUPAC name of 6-amino-N-(4-methylcycloheptyl)hexanamide (CID 114100037) is 6-amino-N-(4-methylcycloheptyl)hexanamide.
What is the SMILES notation for 6-amino-N-(4-methylcycloheptyl)hexanamide?
The canonical SMILES for 6-amino-N-(4-methylcycloheptyl)hexanamide is CC1CCCC(NC(=O)CCCCCN)CC1.
What is the InChIKey of 6-amino-N-(4-methylcycloheptyl)hexanamide?
The InChIKey is DIKKTOIAYQEWLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12-6-5-7-13(10-9-12)16-14(17)8-3-2-4-11-15/h12-13H,2-11,15H2,1H3,(H,16,17).
What are the key properties of 6-amino-N-(4-methylcycloheptyl)hexanamide?
6-amino-N-(4-methylcycloheptyl)hexanamide has a molecular weight of 240.39 g/mol, XLogP of 2.59, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(4-methylcycloheptyl)hexanamide is sourced from PubChem (CID 114100037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).