1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine

C17H22N4 — CID 115904145

IUPAC1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine
SMILESCC1CC(Nc2ccccc2-n2cccn2)CN1C1CC1
InChIInChI=1S/C17H22N4/c1-13-11-14(12-20(13)15-7-8-15)19-16-5-2-3-6-17(16)21-10-4-9-18-21/h2-6,9-10,13-15,19H,7-8,11-12H2,1H3
InChIKeyUNIWKBYPYMHDDC-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.91
Rot. Bonds4

About 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine

1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine (PubChem CID 115904145) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine
PubChem CID115904145
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine
SMILESCC1CC(Nc2ccccc2-n2cccn2)CN1C1CC1
InChIInChI=1S/C17H22N4/c1-13-11-14(12-20(13)15-7-8-15)19-16-5-2-3-6-17(16)21-10-4-9-18-21/h2-6,9-10,13-15,19H,7-8,11-12H2,1H3
InChIKeyUNIWKBYPYMHDDC-UHFFFAOYSA-N
XLogP2.91
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-5-methyl-N-naphthalen-1-ylpyrrolidin-3-amine
CID 115928211
N-(3-ethylcyclopentyl)-2-pyrazol-1-ylaniline
CID 64501492
N-(3-cyclopropylcyclohexyl)-2-pyrazol-1-ylaniline
CID 64596048
1-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 115904143
N-(2-pyrazol-1-ylphenyl)oxan-4-amine
CID 43705664
N-(3-methoxycyclohexyl)-2-pyrazol-1-ylaniline
CID 106871747
4,4-dimethyl-N-(2-pyrazol-1-ylphenyl)cycloheptan-1-amine
CID 65084094
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)quinolin-5-amine
CID 115928349
1-cyclopropyl-N-(2,3-difluorophenyl)-5-methylpyrrolidin-3-amine
CID 113491642
8-methyl-N-[2-(triazol-1-yl)phenyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 43676149
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-2-propan-2-yloxypyridin-3-amine
CID 115922180
1-cyclopropyl-5-methyl-N-(2-prop-2-enylsulfanylphenyl)pyrrolidin-3-amine
CID 115904201

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine?
The IUPAC name of 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine (CID 115904145) is 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine?
The canonical SMILES for 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine is CC1CC(Nc2ccccc2-n2cccn2)CN1C1CC1.
What is the InChIKey of 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine?
The InChIKey is UNIWKBYPYMHDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-13-11-14(12-20(13)15-7-8-15)19-16-5-2-3-6-17(16)21-10-4-9-18-21/h2-6,9-10,13-15,19H,7-8,11-12H2,1H3.
What are the key properties of 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine?
1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine has a molecular weight of 282.39 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine is sourced from PubChem (CID 115904145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).