N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine

C16H31N — CID 107417481

IUPACN-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(NCC2CCCC2C)CC1
InChIInChI=1S/C16H31N/c1-3-5-14-8-10-16(11-9-14)17-12-15-7-4-6-13(15)2/h13-17H,3-12H2,1-2H3
InChIKeyYKIFSIVVROJKSZ-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.37
Rot. Bonds5

About N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine

N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine (PubChem CID 107417481) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine
PubChem CID107417481
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC NameN-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(NCC2CCCC2C)CC1
InChIInChI=1S/C16H31N/c1-3-5-14-8-10-16(11-9-14)17-12-15-7-4-6-13(15)2/h13-17H,3-12H2,1-2H3
InChIKeyYKIFSIVVROJKSZ-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-methylcyclopentyl)methyl]cyclooctanamine
CID 107417462
3-N-[(2-methylcyclopentyl)methyl]cyclopentane-1,3-diamine
CID 107417313
3-[[(4-propylcycloheptyl)amino]methyl]cyclohexan-1-ol
CID 106124372
N-[(2-propylcycloheptyl)methyl]cyclopropanamine
CID 81026279
4-[[(4-propylcycloheptyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79530082
1-[2-(2-methylcyclopropyl)ethyl]-4-propylcycloheptane
CID 123786912
4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106638181
N-[(3-propylcyclobutyl)methyl]cyclopentanamine
CID 97034535
N-(2,2-dimethylpropyl)-4-propylcycloheptan-1-amine
CID 65091749
N-[(2-octylcyclopentyl)methyl]cyclopropanamine
CID 81033237
N-[(1-ethylpiperidin-4-yl)methyl]-4-propylcycloheptan-1-amine
CID 65091371
N-(oxolan-3-ylmethyl)-4-propylcycloheptan-1-amine
CID 65091062

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine?
The IUPAC name of N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine (CID 107417481) is N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine.
What is the SMILES notation for N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine?
The canonical SMILES for N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine is CCCC1CCC(NCC2CCCC2C)CC1.
What is the InChIKey of N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine?
The InChIKey is YKIFSIVVROJKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-3-5-14-8-10-16(11-9-14)17-12-15-7-4-6-13(15)2/h13-17H,3-12H2,1-2H3.
What are the key properties of N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine?
N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopentyl)methyl]-4-propylcyclohexan-1-amine is sourced from PubChem (CID 107417481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).