5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine

C7H12N4 — CID 82502577

IUPAC5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine
SMILESNCc1[nH]nc(C2CC2)c1N
InChIInChI=1S/C7H12N4/c8-3-5-6(9)7(11-10-5)4-1-2-4/h4H,1-3,8-9H2,(H,10,11)
InChIKeyMEZKYEGEFPTAJZ-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.33
Rot. Bonds2

About 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine

5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine (PubChem CID 82502577) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine.

Molecular Properties

Compound Name5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine
PubChem CID82502577
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine
SMILESNCc1[nH]nc(C2CC2)c1N
InChIInChI=1S/C7H12N4/c8-3-5-6(9)7(11-10-5)4-1-2-4/h4H,1-3,8-9H2,(H,10,11)
InChIKeyMEZKYEGEFPTAJZ-UHFFFAOYSA-N
XLogP0.33
TPSA80.72 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine?
The IUPAC name of 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine (CID 82502577) is 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine.
What is the SMILES notation for 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine?
The canonical SMILES for 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine is NCc1[nH]nc(C2CC2)c1N.
What is the InChIKey of 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine?
The InChIKey is MEZKYEGEFPTAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c8-3-5-6(9)7(11-10-5)4-1-2-4/h4H,1-3,8-9H2,(H,10,11).
What are the key properties of 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine?
5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine has a molecular weight of 152.20 g/mol, XLogP of 0.33, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-3-cyclopropyl-1H-pyrazol-4-amine is sourced from PubChem (CID 82502577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).