4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide

C14H22N4O — CID 62077958

IUPAC4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide
SMILESCC1(NC(=O)c2n[nH]c(C3CC3)c2N)CCCCC1
InChIInChI=1S/C14H22N4O/c1-14(7-3-2-4-8-14)16-13(19)12-10(15)11(17-18-12)9-5-6-9/h9H,2-8,15H2,1H3,(H,16,19)(H,17,18)
InChIKeyODAFADNRSAOUEH-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.32
Rot. Bonds3

About 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide (PubChem CID 62077958) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide
PubChem CID62077958
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide
SMILESCC1(NC(=O)c2n[nH]c(C3CC3)c2N)CCCCC1
InChIInChI=1S/C14H22N4O/c1-14(7-3-2-4-8-14)16-13(19)12-10(15)11(17-18-12)9-5-6-9/h9H,2-8,15H2,1H3,(H,16,19)(H,17,18)
InChIKeyODAFADNRSAOUEH-UHFFFAOYSA-N
XLogP2.32
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide (CID 62077958) is 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide is CC1(NC(=O)c2n[nH]c(C3CC3)c2N)CCCCC1.
What is the InChIKey of 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
The InChIKey is ODAFADNRSAOUEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-14(7-3-2-4-8-14)16-13(19)12-10(15)11(17-18-12)9-5-6-9/h9H,2-8,15H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 2.32, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-(1-methylcyclohexyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62077958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).