N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine

C14H22N2 — CID 104736957

IUPACN-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine
SMILESCCCNC1CCCC1Cc1cccnc1
InChIInChI=1S/C14H22N2/c1-2-8-16-14-7-3-6-13(14)10-12-5-4-9-15-11-12/h4-5,9,11,13-14,16H,2-3,6-8,10H2,1H3
InChIKeyNCAFJEATHTZREZ-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.79
Rot. Bonds5

About N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine

N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine (PubChem CID 104736957) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine
PubChem CID104736957
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine
SMILESCCCNC1CCCC1Cc1cccnc1
InChIInChI=1S/C14H22N2/c1-2-8-16-14-7-3-6-13(14)10-12-5-4-9-15-11-12/h4-5,9,11,13-14,16H,2-3,6-8,10H2,1H3
InChIKeyNCAFJEATHTZREZ-UHFFFAOYSA-N
XLogP2.79
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[methyl(pyridin-3-ylmethyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 62615844
2-[(1-methylpyrazol-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 62127989
N-propyl-3-(pyridin-3-ylmethyl)cycloheptan-1-amine
CID 104737007
2-[(4-methylphenyl)methyl]-N-propylcyclohexan-1-amine
CID 55185583
2-tert-butyl-N-(2-pyridin-3-ylethyl)cyclohexan-1-amine
CID 60894469
N-[[4-methyl-2-(pyridin-3-ylmethyl)cyclohexyl]methyl]propan-1-amine
CID 104737396
[2-(pyridin-3-ylmethylamino)cyclohexyl]methanol
CID 111440219
2-methylsulfanyl-N-(2-pyridin-3-ylethyl)cyclohexan-1-amine
CID 103777301
2-[(2-methylphenyl)methyl]-N-propylcyclohexan-1-amine
CID 61382239
2-[(2,6-difluorophenyl)methyl]-N-propylcyclohexan-1-amine
CID 114930724
2-[(2-bromophenyl)methyl]-N-propylcyclohexan-1-amine
CID 63399753
2-[(2,5-dimethylphenyl)methyl]-N-propylcyclopentan-1-amine
CID 54957693

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine?
The IUPAC name of N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine (CID 104736957) is N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine is CCCNC1CCCC1Cc1cccnc1.
What is the InChIKey of N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine?
The InChIKey is NCAFJEATHTZREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-2-8-16-14-7-3-6-13(14)10-12-5-4-9-15-11-12/h4-5,9,11,13-14,16H,2-3,6-8,10H2,1H3.
What are the key properties of N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine?
N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine has a molecular weight of 218.34 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(pyridin-3-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 104736957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).