1-(cyclobutylmethyl)pyrazol-4-amine

C8H13N3 — CID 64985324

IUPAC1-(cyclobutylmethyl)pyrazol-4-amine
SMILESNc1cnn(CC2CCC2)c1
InChIInChI=1S/C8H13N3/c9-8-4-10-11(6-8)5-7-2-1-3-7/h4,6-7H,1-3,5,9H2
InChIKeyJBCYDWWWDGLPBA-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.27
Rot. Bonds2

About 1-(cyclobutylmethyl)pyrazol-4-amine

1-(cyclobutylmethyl)pyrazol-4-amine (PubChem CID 64985324) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)pyrazol-4-amine
PubChem CID64985324
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-(cyclobutylmethyl)pyrazol-4-amine
SMILESNc1cnn(CC2CCC2)c1
InChIInChI=1S/C8H13N3/c9-8-4-10-11(6-8)5-7-2-1-3-7/h4,6-7H,1-3,5,9H2
InChIKeyJBCYDWWWDGLPBA-UHFFFAOYSA-N
XLogP1.27
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)pyrazol-4-amine?
The IUPAC name of 1-(cyclobutylmethyl)pyrazol-4-amine (CID 64985324) is 1-(cyclobutylmethyl)pyrazol-4-amine.
What is the SMILES notation for 1-(cyclobutylmethyl)pyrazol-4-amine?
The canonical SMILES for 1-(cyclobutylmethyl)pyrazol-4-amine is Nc1cnn(CC2CCC2)c1.
What is the InChIKey of 1-(cyclobutylmethyl)pyrazol-4-amine?
The InChIKey is JBCYDWWWDGLPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c9-8-4-10-11(6-8)5-7-2-1-3-7/h4,6-7H,1-3,5,9H2.
What are the key properties of 1-(cyclobutylmethyl)pyrazol-4-amine?
1-(cyclobutylmethyl)pyrazol-4-amine has a molecular weight of 151.21 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)pyrazol-4-amine is sourced from PubChem (CID 64985324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).