4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide

C11H17N5O2 — CID 62077789

IUPAC4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide
SMILESCNC(=O)C(C)NC(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C11H17N5O2/c1-5(10(17)13-2)14-11(18)9-7(12)8(15-16-9)6-3-4-6/h5-6H,3-4,12H2,1-2H3,(H,13,17)(H,14,18)(H,15,16)
InChIKeyQNYHVSZRVBUZAS-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.27
Rot. Bonds4

About 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide (PubChem CID 62077789) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide
PubChem CID62077789
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide
SMILESCNC(=O)C(C)NC(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C11H17N5O2/c1-5(10(17)13-2)14-11(18)9-7(12)8(15-16-9)6-3-4-6/h5-6H,3-4,12H2,1-2H3,(H,13,17)(H,14,18)(H,15,16)
InChIKeyQNYHVSZRVBUZAS-UHFFFAOYSA-N
XLogP-0.27
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide (CID 62077789) is 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide is CNC(=O)C(C)NC(=O)c1n[nH]c(C2CC2)c1N.
What is the InChIKey of 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is QNYHVSZRVBUZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-5(10(17)13-2)14-11(18)9-7(12)8(15-16-9)6-3-4-6/h5-6H,3-4,12H2,1-2H3,(H,13,17)(H,14,18)(H,15,16).
What are the key properties of 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.27, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-[1-(methylamino)-1-oxopropan-2-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62077789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).