4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide

C12H16N6O — CID 106208104

IUPAC4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCC(NC(=O)c1n[nH]c(C2CC2)c1N)c1cn[nH]c1
InChIInChI=1S/C12H16N6O/c1-6(8-4-14-15-5-8)16-12(19)11-9(13)10(17-18-11)7-2-3-7/h4-7H,2-3,13H2,1H3,(H,14,15)(H,16,19)(H,17,18)
InChIKeySYYYWDTWIPPLHB-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.08
Rot. Bonds4

About 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 106208104) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide
PubChem CID106208104
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC Name4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCC(NC(=O)c1n[nH]c(C2CC2)c1N)c1cn[nH]c1
InChIInChI=1S/C12H16N6O/c1-6(8-4-14-15-5-8)16-12(19)11-9(13)10(17-18-11)7-2-3-7/h4-7H,2-3,13H2,1H3,(H,14,15)(H,16,19)(H,17,18)
InChIKeySYYYWDTWIPPLHB-UHFFFAOYSA-N
XLogP1.08
TPSA112.48 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide (CID 106208104) is 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide is CC(NC(=O)c1n[nH]c(C2CC2)c1N)c1cn[nH]c1.
What is the InChIKey of 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is SYYYWDTWIPPLHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O/c1-6(8-4-14-15-5-8)16-12(19)11-9(13)10(17-18-11)7-2-3-7/h4-7H,2-3,13H2,1H3,(H,14,15)(H,16,19)(H,17,18).
What are the key properties of 4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 1.08, 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-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 106208104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).