N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine

C11H17N3 — CID 63761781

IUPACN-[1-(aminomethyl)cyclopentyl]pyridin-4-amine
SMILESNCC1(Nc2ccncc2)CCCC1
InChIInChI=1S/C11H17N3/c12-9-11(5-1-2-6-11)14-10-3-7-13-8-4-10/h3-4,7-8H,1-2,5-6,9,12H2,(H,13,14)
InChIKeyQERDPRQEZVSEHG-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.76
Rot. Bonds3

About N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine

N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine (PubChem CID 63761781) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]pyridin-4-amine
PubChem CID63761781
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC NameN-[1-(aminomethyl)cyclopentyl]pyridin-4-amine
SMILESNCC1(Nc2ccncc2)CCCC1
InChIInChI=1S/C11H17N3/c12-9-11(5-1-2-6-11)14-10-3-7-13-8-4-10/h3-4,7-8H,1-2,5-6,9,12H2,(H,13,14)
InChIKeyQERDPRQEZVSEHG-UHFFFAOYSA-N
XLogP1.76
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine (CID 63761781) is N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine is NCC1(Nc2ccncc2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine?
The InChIKey is QERDPRQEZVSEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c12-9-11(5-1-2-6-11)14-10-3-7-13-8-4-10/h3-4,7-8H,1-2,5-6,9,12H2,(H,13,14).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine?
N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine has a molecular weight of 191.28 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine is sourced from PubChem (CID 63761781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).