6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H19N5O — CID 167763963

IUPAC6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNCCc1cnc2c(C(=O)Nc3ccccc3C3CC3)cnn2c1
InChIInChI=1S/C18H19N5O/c19-8-7-12-9-20-17-15(10-21-23(17)11-12)18(24)22-16-4-2-1-3-14(16)13-5-6-13/h1-4,9-11,13H,5-8,19H2,(H,22,24)
InChIKeyPCGLFIXFKWUCSK-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.36
Rot. Bonds5

About 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 167763963) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID167763963
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC Name6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNCCc1cnc2c(C(=O)Nc3ccccc3C3CC3)cnn2c1
InChIInChI=1S/C18H19N5O/c19-8-7-12-9-20-17-15(10-21-23(17)11-12)18(24)22-16-4-2-1-3-14(16)13-5-6-13/h1-4,9-11,13H,5-8,19H2,(H,22,24)
InChIKeyPCGLFIXFKWUCSK-UHFFFAOYSA-N
XLogP2.36
TPSA85.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(diethylaminomethyl)-N-(2,3-dihydro-1H-inden-1-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56760299
cyclopropane;N-(2-cyclopropylphenyl)-3-(difluoromethyl)-1-methylpyrazole-4-carboxamide;ethane
CID 143209520
6-(aminomethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 114514794
6-(2-hydroxyethyl)-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 74233515
6-(3-hydroxypropyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 58056251
N-(2-hydroxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414443
6-(diethylaminomethyl)-N-(2-methyl-1-benzofuran-7-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56718006
N-[(3S)-1-(cyclohexylmethyl)piperidin-3-yl]-6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 95716198
[6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidin-3-yl]-[(3S)-3-(2-phenylethyl)piperidin-1-yl]methanone
CID 95398964
N-[2-(3-cyclopropylcyclobutyl)phenyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 70888464
6-(diethylaminomethyl)-N-(6-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56717535
[(3R,3aS,6aS)-2-methyl-3-(2-methylphenyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-[6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;hydrochloride
CID 171710382

Frequently Asked Questions

What is the IUPAC name of 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 167763963) is 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is NCCc1cnc2c(C(=O)Nc3ccccc3C3CC3)cnn2c1.
What is the InChIKey of 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is PCGLFIXFKWUCSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c19-8-7-12-9-20-17-15(10-21-23(17)11-12)18(24)22-16-4-2-1-3-14(16)13-5-6-13/h1-4,9-11,13H,5-8,19H2,(H,22,24).
What are the key properties of 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminoethyl)-N-(2-cyclopropylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 167763963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).