N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide

C11H17N3O — CID 42818255

IUPACN-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)c1c(C(=O)NC2CC2)cnn1C
InChIInChI=1S/C11H17N3O/c1-7(2)10-9(6-12-14(10)3)11(15)13-8-4-5-8/h6-8H,4-5H2,1-3H3,(H,13,15)
InChIKeyJOGQKNWITMWUMN-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.44
Rot. Bonds3

About N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide

N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide (PubChem CID 42818255) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide
PubChem CID42818255
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C)c1c(C(=O)NC2CC2)cnn1C
InChIInChI=1S/C11H17N3O/c1-7(2)10-9(6-12-14(10)3)11(15)13-8-4-5-8/h6-8H,4-5H2,1-3H3,(H,13,15)
InChIKeyJOGQKNWITMWUMN-UHFFFAOYSA-N
XLogP1.44
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(4-Aminocyclohexyl)-5-methylpyrazol-4-yl]butan-1-one
CID 90105500
3-Cyclopropyl-1-ethyl-1H-pyrazole-4-carbaldehyde
CID 19621360
1-Methyl-5-(1-methylethyl)-1H-pyrazole-4-carboxaldehyde
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5-Cyclopropyl-1-methyl-1H-pyrazole-4-carbaldehyde
CID 51072283
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]cyclopentanecarboxamide
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4-(1-Tert-butyl-5-ethylpyrazole-4-carbonyl)piperazin-2-one
CID 45830695
N-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-5-methyl-1-propylpyrazole-4-carboxamide
CID 46968232
2-[1-(1-Tert-butyl-5-ethylpyrazole-4-carbonyl)piperidin-4-yl]acetamide
CID 53511115
2-[4-(1-Tert-butyl-5-ethylpyrazole-4-carbonyl)piperazin-1-yl]acetamide
CID 53526983
(1-Tert-butyl-5-ethylpyrazol-4-yl)-[3-(dimethylamino)piperidin-1-yl]methanone
CID 53541073
1-[4-(1-Tert-butyl-5-ethylpyrazole-4-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 56817790
N-[3-(cyclohexylamino)-3-oxopropyl]-3-methyl-1-propyl-1H-pyrazole-4-carboxamide
CID 72862716

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide (CID 42818255) is N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide is CC(C)c1c(C(=O)NC2CC2)cnn1C.
What is the InChIKey of N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is JOGQKNWITMWUMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-7(2)10-9(6-12-14(10)3)11(15)13-8-4-5-8/h6-8H,4-5H2,1-3H3,(H,13,15).
What are the key properties of N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide?
N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-methyl-5-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 42818255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).