N-(cyclopentylmethyl)-1-methylpyrazol-3-amine

C10H17N3 — CID 62072265

IUPACN-(cyclopentylmethyl)-1-methylpyrazol-3-amine
SMILESCn1ccc(NCC2CCCC2)n1
InChIInChI=1S/C10H17N3/c1-13-7-6-10(12-13)11-8-9-4-2-3-5-9/h6-7,9H,2-5,8H2,1H3,(H,11,12)
InChIKeyFLAYHFQAQINHRV-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.02
Rot. Bonds3

About N-(cyclopentylmethyl)-1-methylpyrazol-3-amine

N-(cyclopentylmethyl)-1-methylpyrazol-3-amine (PubChem CID 62072265) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-1-methylpyrazol-3-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-1-methylpyrazol-3-amine
PubChem CID62072265
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-(cyclopentylmethyl)-1-methylpyrazol-3-amine
SMILESCn1ccc(NCC2CCCC2)n1
InChIInChI=1S/C10H17N3/c1-13-7-6-10(12-13)11-8-9-4-2-3-5-9/h6-7,9H,2-5,8H2,1H3,(H,11,12)
InChIKeyFLAYHFQAQINHRV-UHFFFAOYSA-N
XLogP2.02
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-1-methylpyrazol-3-amine?
The IUPAC name of N-(cyclopentylmethyl)-1-methylpyrazol-3-amine (CID 62072265) is N-(cyclopentylmethyl)-1-methylpyrazol-3-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-1-methylpyrazol-3-amine?
The canonical SMILES for N-(cyclopentylmethyl)-1-methylpyrazol-3-amine is Cn1ccc(NCC2CCCC2)n1.
What is the InChIKey of N-(cyclopentylmethyl)-1-methylpyrazol-3-amine?
The InChIKey is FLAYHFQAQINHRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-13-7-6-10(12-13)11-8-9-4-2-3-5-9/h6-7,9H,2-5,8H2,1H3,(H,11,12).
What are the key properties of N-(cyclopentylmethyl)-1-methylpyrazol-3-amine?
N-(cyclopentylmethyl)-1-methylpyrazol-3-amine has a molecular weight of 179.27 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-1-methylpyrazol-3-amine is sourced from PubChem (CID 62072265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).