N-[(4-aminocyclohexyl)methyl]pentanamide

C12H24N2O — CID 106124302

IUPACN-[(4-aminocyclohexyl)methyl]pentanamide
SMILESCCCCC(=O)NCC1CCC(N)CC1
InChIInChI=1S/C12H24N2O/c1-2-3-4-12(15)14-9-10-5-7-11(13)8-6-10/h10-11H,2-9,13H2,1H3,(H,14,15)
InChIKeyCAUAZHCYULYRPH-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.81
Rot. Bonds5

About N-[(4-aminocyclohexyl)methyl]pentanamide

N-[(4-aminocyclohexyl)methyl]pentanamide (PubChem CID 106124302) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[(4-aminocyclohexyl)methyl]pentanamide.

Molecular Properties

Compound NameN-[(4-aminocyclohexyl)methyl]pentanamide
PubChem CID106124302
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[(4-aminocyclohexyl)methyl]pentanamide
SMILESCCCCC(=O)NCC1CCC(N)CC1
InChIInChI=1S/C12H24N2O/c1-2-3-4-12(15)14-9-10-5-7-11(13)8-6-10/h10-11H,2-9,13H2,1H3,(H,14,15)
InChIKeyCAUAZHCYULYRPH-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(pentanoylamino)methyl]cyclohexane-1-carboxylic acid
CID 21470545
N-[(3-chlorocyclopentyl)methyl]pentanamide
CID 106127433
N-[(4-chlorocyclohexyl)methyl]octanamide
CID 106133761
N-[(1-acetylpiperidin-4-yl)methyl]pentanamide
CID 110736125
N-[(4-aminocyclohexyl)methyl]-4-methoxypentanamide
CID 106124719
N-(piperidin-4-ylmethyl)heptanamide
CID 115736684
7-amino-N-(cyclopropylmethyl)heptanamide
CID 24705524
N-[(4-chlorocyclohexyl)methyl]butanamide
CID 106133703
N-(cyclopropylmethyl)-4-(methylamino)butanamide
CID 60841851
6-amino-N-(cyclopropylmethyl)hexanamide
CID 24707919
N-[(4-aminocyclohexyl)methyl]-3-cyclohexylpropanamide
CID 106124035
5-[(4-methylcyclohexyl)methylamino]-5-oxopentanoic acid
CID 63243932

Frequently Asked Questions

What is the IUPAC name of N-[(4-aminocyclohexyl)methyl]pentanamide?
The IUPAC name of N-[(4-aminocyclohexyl)methyl]pentanamide (CID 106124302) is N-[(4-aminocyclohexyl)methyl]pentanamide.
What is the SMILES notation for N-[(4-aminocyclohexyl)methyl]pentanamide?
The canonical SMILES for N-[(4-aminocyclohexyl)methyl]pentanamide is CCCCC(=O)NCC1CCC(N)CC1.
What is the InChIKey of N-[(4-aminocyclohexyl)methyl]pentanamide?
The InChIKey is CAUAZHCYULYRPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-2-3-4-12(15)14-9-10-5-7-11(13)8-6-10/h10-11H,2-9,13H2,1H3,(H,14,15).
What are the key properties of N-[(4-aminocyclohexyl)methyl]pentanamide?
N-[(4-aminocyclohexyl)methyl]pentanamide has a molecular weight of 212.34 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-aminocyclohexyl)methyl]pentanamide is sourced from PubChem (CID 106124302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).