7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide

C15H30N2O — CID 55012025

IUPAC7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide
SMILESCC1CCCCC1CNC(=O)CCCCCCN
InChIInChI=1S/C15H30N2O/c1-13-8-5-6-9-14(13)12-17-15(18)10-4-2-3-7-11-16/h13-14H,2-12,16H2,1H3,(H,17,18)
InChIKeyRSGZNBOONOYVIS-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.84
Rot. Bonds8

About 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide

7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide (PubChem CID 55012025) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide.

Molecular Properties

Compound Name7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide
PubChem CID55012025
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide
SMILESCC1CCCCC1CNC(=O)CCCCCCN
InChIInChI=1S/C15H30N2O/c1-13-8-5-6-9-14(13)12-17-15(18)10-4-2-3-7-11-16/h13-14H,2-12,16H2,1H3,(H,17,18)
InChIKeyRSGZNBOONOYVIS-UHFFFAOYSA-N
XLogP2.84
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
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-amino-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107417700
5-hydroxy-N-[(2-methylcyclopentyl)methyl]pentanamide
CID 107420801
5-bromo-N-[(2-methylcyclopentyl)methyl]pentanamide
CID 107910816
6-amino-N-(cyclohexylmethyl)hexanamide
CID 43371592
N-[(2-methylcyclopentyl)methyl]butanamide
CID 107420814
6-amino-N-(cyclopropylmethyl)hexanamide
CID 24707919
7-amino-N-(cyclopropylmethyl)heptanamide
CID 24705524
3-bromo-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107417690
7-amino-N-[(2-tert-butyloxan-3-yl)methyl]heptanamide;hydrochloride
CID 119795866
4-amino-N-[(2-methylcyclopentyl)methyl]pentanamide
CID 107418378
N-[(2-methylcyclohexyl)methyl]-3-(propan-2-ylamino)propanamide
CID 55012121
6-amino-N-[(4-hydroxycyclohexyl)methyl]hexanamide
CID 106135658

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide?
The IUPAC name of 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide (CID 55012025) is 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide.
What is the SMILES notation for 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide?
The canonical SMILES for 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide is CC1CCCCC1CNC(=O)CCCCCCN.
What is the InChIKey of 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide?
The InChIKey is RSGZNBOONOYVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-13-8-5-6-9-14(13)12-17-15(18)10-4-2-3-7-11-16/h13-14H,2-12,16H2,1H3,(H,17,18).
What are the key properties of 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide?
7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide has a molecular weight of 254.42 g/mol, XLogP of 2.84, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[(2-methylcyclohexyl)methyl]heptanamide is sourced from PubChem (CID 55012025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).