N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide

C15H25N3O — CID 95288937

IUPACN-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide
SMILESCC[C@@H](NC(=O)c1cnn(C)c1C)C1CCCCC1
InChIInChI=1S/C15H25N3O/c1-4-14(12-8-6-5-7-9-12)17-15(19)13-10-16-18(3)11(13)2/h10,12,14H,4-9H2,1-3H3,(H,17,19)/t14-/m1/s1
InChIKeyOGXJVNAGXPVACE-CQSZACIVSA-N
MW263.38 g/mol
LogP2.82
Rot. Bonds4

About N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide

N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide (PubChem CID 95288937) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide
PubChem CID95288937
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide
SMILESCC[C@@H](NC(=O)c1cnn(C)c1C)C1CCCCC1
InChIInChI=1S/C15H25N3O/c1-4-14(12-8-6-5-7-9-12)17-15(19)13-10-16-18(3)11(13)2/h10,12,14H,4-9H2,1-3H3,(H,17,19)/t14-/m1/s1
InChIKeyOGXJVNAGXPVACE-CQSZACIVSA-N
XLogP2.82
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide (CID 95288937) is N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide is CC[C@@H](NC(=O)c1cnn(C)c1C)C1CCCCC1.
What is the InChIKey of N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide?
The InChIKey is OGXJVNAGXPVACE-CQSZACIVSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-14(12-8-6-5-7-9-12)17-15(19)13-10-16-18(3)11(13)2/h10,12,14H,4-9H2,1-3H3,(H,17,19)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide?
N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclohexylpropyl]-1,5-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 95288937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).