3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine

C10H18N4 — CID 112711299

IUPAC3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine
SMILESCC(C)n1nc(CN)cc1NC1CC1
InChIInChI=1S/C10H18N4/c1-7(2)14-10(12-8-3-4-8)5-9(6-11)13-14/h5,7-8,12H,3-4,6,11H2,1-2H3
InChIKeyWCUCIKFXFNOLPD-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.50
Rot. Bonds4

About 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine

3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine (PubChem CID 112711299) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine
PubChem CID112711299
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine
SMILESCC(C)n1nc(CN)cc1NC1CC1
InChIInChI=1S/C10H18N4/c1-7(2)14-10(12-8-3-4-8)5-9(6-11)13-14/h5,7-8,12H,3-4,6,11H2,1-2H3
InChIKeyWCUCIKFXFNOLPD-UHFFFAOYSA-N
XLogP1.50
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine?
The IUPAC name of 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine (CID 112711299) is 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine.
What is the SMILES notation for 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine?
The canonical SMILES for 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine is CC(C)n1nc(CN)cc1NC1CC1.
What is the InChIKey of 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine?
The InChIKey is WCUCIKFXFNOLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-7(2)14-10(12-8-3-4-8)5-9(6-11)13-14/h5,7-8,12H,3-4,6,11H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine?
3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine has a molecular weight of 194.28 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-cyclopropyl-1-propan-2-ylpyrazol-5-amine is sourced from PubChem (CID 112711299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).