5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide

C19H23N3O2 — CID 139012188

IUPAC5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide
SMILESCOCC(NC(=O)c1cnn(-c2ccccc2)c1C1CC1)C1CC1
InChIInChI=1S/C19H23N3O2/c1-24-12-17(13-7-8-13)21-19(23)16-11-20-22(18(16)14-9-10-14)15-5-3-2-4-6-15/h2-6,11,13-14,17H,7-10,12H2,1H3,(H,21,23)
InChIKeyCKIZGXRTANASIG-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.90
Rot. Bonds7

About 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide

5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide (PubChem CID 139012188) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide
PubChem CID139012188
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide
SMILESCOCC(NC(=O)c1cnn(-c2ccccc2)c1C1CC1)C1CC1
InChIInChI=1S/C19H23N3O2/c1-24-12-17(13-7-8-13)21-19(23)16-11-20-22(18(16)14-9-10-14)15-5-3-2-4-6-15/h2-6,11,13-14,17H,7-10,12H2,1H3,(H,21,23)
InChIKeyCKIZGXRTANASIG-UHFFFAOYSA-N
XLogP2.90
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyclopropyl-N-(1-methoxypropan-2-yl)-1-phenylpyrazole-4-carboxamide
CID 42949053
N-[(2S)-1-aminopropan-2-yl]-5-cyclopropyl-1-phenylpyrazole-4-carboxamide;hydrochloride
CID 120505954
N-(3-aminobutyl)-5-cyclopropyl-1-phenylpyrazole-4-carboxamide;hydrochloride
CID 119498276
5-cyclopropyl-1-phenyl-N-[1-[4-(phenylcarbamoylamino)phenyl]ethyl]pyrazole-4-carboxamide
CID 112827858
5-amino-1-phenyl-N-propan-2-ylpyrazole-4-carboxamide
CID 14118804
3-[[5-cyclopropyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]amino]butanoic acid
CID 119220762
(5-cyclopropyl-1-phenylpyrazol-4-yl)-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 119647191
3-[(5-cyclopropyl-1-phenylpyrazole-4-carbonyl)amino]bicyclo[1.1.1]pentane-1-carboxylic acid
CID 166271063
N-(4-aminocyclohexyl)-5-cyclopropyl-1-phenylpyrazole-4-carboxamide;hydrochloride
CID 119477727
5-cyclopropyl-N-(2,3-dimethylcyclohexyl)-1-phenylpyrazole-4-carboxamide
CID 112814365
5-cyclopropyl-1-(2,4-dichlorophenyl)-N-(1-methoxypropan-2-yl)pyrazole-4-carboxamide
CID 55604750
5-cyclopropyl-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid
CID 63173747

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide (CID 139012188) is 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide is COCC(NC(=O)c1cnn(-c2ccccc2)c1C1CC1)C1CC1.
What is the InChIKey of 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide?
The InChIKey is CKIZGXRTANASIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-24-12-17(13-7-8-13)21-19(23)16-11-20-22(18(16)14-9-10-14)15-5-3-2-4-6-15/h2-6,11,13-14,17H,7-10,12H2,1H3,(H,21,23).
What are the key properties of 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide?
5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(1-cyclopropyl-2-methoxyethyl)-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 139012188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).