7-amino-N-cycloheptyl-N-methylheptanamide

C15H30N2O — CID 43614064

IUPAC7-amino-N-cycloheptyl-N-methylheptanamide
SMILESCN(C(=O)CCCCCCN)C1CCCCCC1
InChIInChI=1S/C15H30N2O/c1-17(14-10-6-2-3-7-11-14)15(18)12-8-4-5-9-13-16/h14H,2-13,16H2,1H3
InChIKeyKGVNATCWGWWITG-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.08
Rot. Bonds7

About 7-amino-N-cycloheptyl-N-methylheptanamide

7-amino-N-cycloheptyl-N-methylheptanamide (PubChem CID 43614064) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 7-amino-N-cycloheptyl-N-methylheptanamide.

Molecular Properties

Compound Name7-amino-N-cycloheptyl-N-methylheptanamide
PubChem CID43614064
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name7-amino-N-cycloheptyl-N-methylheptanamide
SMILESCN(C(=O)CCCCCCN)C1CCCCCC1
InChIInChI=1S/C15H30N2O/c1-17(14-10-6-2-3-7-11-14)15(18)12-8-4-5-9-13-16/h14H,2-13,16H2,1H3
InChIKeyKGVNATCWGWWITG-UHFFFAOYSA-N
XLogP3.08
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.08
H-Bond Donors ≤ 51
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-cyclooctyl-N-methylheptanamide
CID 119763844
6-amino-N-cyclopentyl-N-methylhexanamide
CID 43267226
7-amino-N-methyl-N-(3-methylcyclohexyl)heptanamide
CID 54949044
7-amino-N-methyl-N-(oxan-4-yl)heptanamide
CID 43611104
6-amino-N-methyl-N-(oxan-4-yl)hexanamide
CID 43611096
6-amino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)hexanamide
CID 54870299
7-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]heptanamide
CID 60954276
4-amino-N-methyl-N-(1-methylpiperidin-4-yl)butanamide
CID 60731508
3-amino-N-(4-cyclohexylcyclohexyl)-N-methylpropanamide
CID 21479311
N-cycloheptyl-2-hydroxy-N-methylacetamide
CID 130678772
3-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylpropanamide
CID 54873292
N-(3-aminopropyl)-N-cycloheptylheptanamide
CID 114751887

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-cycloheptyl-N-methylheptanamide?
The IUPAC name of 7-amino-N-cycloheptyl-N-methylheptanamide (CID 43614064) is 7-amino-N-cycloheptyl-N-methylheptanamide.
What is the SMILES notation for 7-amino-N-cycloheptyl-N-methylheptanamide?
The canonical SMILES for 7-amino-N-cycloheptyl-N-methylheptanamide is CN(C(=O)CCCCCCN)C1CCCCCC1.
What is the InChIKey of 7-amino-N-cycloheptyl-N-methylheptanamide?
The InChIKey is KGVNATCWGWWITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-17(14-10-6-2-3-7-11-14)15(18)12-8-4-5-9-13-16/h14H,2-13,16H2,1H3.
What are the key properties of 7-amino-N-cycloheptyl-N-methylheptanamide?
7-amino-N-cycloheptyl-N-methylheptanamide has a molecular weight of 254.42 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-cycloheptyl-N-methylheptanamide is sourced from PubChem (CID 43614064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).