1-(cyclopentylmethyl)-5-methylpyrazol-3-amine

C10H17N3 — CID 126975451

IUPAC1-(cyclopentylmethyl)-5-methylpyrazol-3-amine
SMILESCc1cc(N)nn1CC1CCCC1
InChIInChI=1S/C10H17N3/c1-8-6-10(11)12-13(8)7-9-4-2-3-5-9/h6,9H,2-5,7H2,1H3,(H2,11,12)
InChIKeyJBSARJWRQSEGHJ-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.96
Rot. Bonds2

About 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine

1-(cyclopentylmethyl)-5-methylpyrazol-3-amine (PubChem CID 126975451) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name1-(cyclopentylmethyl)-5-methylpyrazol-3-amine
PubChem CID126975451
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-(cyclopentylmethyl)-5-methylpyrazol-3-amine
SMILESCc1cc(N)nn1CC1CCCC1
InChIInChI=1S/C10H17N3/c1-8-6-10(11)12-13(8)7-9-4-2-3-5-9/h6,9H,2-5,7H2,1H3,(H2,11,12)
InChIKeyJBSARJWRQSEGHJ-UHFFFAOYSA-N
XLogP1.96
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine?
The IUPAC name of 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine (CID 126975451) is 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine.
What is the SMILES notation for 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine?
The canonical SMILES for 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine is Cc1cc(N)nn1CC1CCCC1.
What is the InChIKey of 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine?
The InChIKey is JBSARJWRQSEGHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-6-10(11)12-13(8)7-9-4-2-3-5-9/h6,9H,2-5,7H2,1H3,(H2,11,12).
What are the key properties of 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine?
1-(cyclopentylmethyl)-5-methylpyrazol-3-amine has a molecular weight of 179.27 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylmethyl)-5-methylpyrazol-3-amine is sourced from PubChem (CID 126975451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).