N-(cyclopentylmethyl)-1H-pyrazol-4-amine

C9H15N3 — CID 62071556

IUPACN-(cyclopentylmethyl)-1H-pyrazol-4-amine
SMILESc1n[nH]cc1NCC1CCCC1
InChIInChI=1S/C9H15N3/c1-2-4-8(3-1)5-10-9-6-11-12-7-9/h6-8,10H,1-5H2,(H,11,12)
InChIKeyJRHAYIHSAKTGLG-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.01
Rot. Bonds3

About N-(cyclopentylmethyl)-1H-pyrazol-4-amine

N-(cyclopentylmethyl)-1H-pyrazol-4-amine (PubChem CID 62071556) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-1H-pyrazol-4-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-1H-pyrazol-4-amine
PubChem CID62071556
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC NameN-(cyclopentylmethyl)-1H-pyrazol-4-amine
SMILESc1n[nH]cc1NCC1CCCC1
InChIInChI=1S/C9H15N3/c1-2-4-8(3-1)5-10-9-6-11-12-7-9/h6-8,10H,1-5H2,(H,11,12)
InChIKeyJRHAYIHSAKTGLG-UHFFFAOYSA-N
XLogP2.01
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-1H-pyrazol-4-amine?
The IUPAC name of N-(cyclopentylmethyl)-1H-pyrazol-4-amine (CID 62071556) is N-(cyclopentylmethyl)-1H-pyrazol-4-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-1H-pyrazol-4-amine?
The canonical SMILES for N-(cyclopentylmethyl)-1H-pyrazol-4-amine is c1n[nH]cc1NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-1H-pyrazol-4-amine?
The InChIKey is JRHAYIHSAKTGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-4-8(3-1)5-10-9-6-11-12-7-9/h6-8,10H,1-5H2,(H,11,12).
What are the key properties of N-(cyclopentylmethyl)-1H-pyrazol-4-amine?
N-(cyclopentylmethyl)-1H-pyrazol-4-amine has a molecular weight of 165.24 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-1H-pyrazol-4-amine is sourced from PubChem (CID 62071556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).