1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine

C11H16N4 — CID 143818183

IUPAC1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine
SMILESCC(C)C1C=CC(n2ccc(N)n2)=CN1
InChIInChI=1S/C11H16N4/c1-8(2)10-4-3-9(7-13-10)15-6-5-11(12)14-15/h3-8,10,13H,1-2H3,(H2,12,14)
InChIKeyWGFFTYDVAFLPDZ-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.45
Rot. Bonds2

About 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine

1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine (PubChem CID 143818183) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine
PubChem CID143818183
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine
SMILESCC(C)C1C=CC(n2ccc(N)n2)=CN1
InChIInChI=1S/C11H16N4/c1-8(2)10-4-3-9(7-13-10)15-6-5-11(12)14-15/h3-8,10,13H,1-2H3,(H2,12,14)
InChIKeyWGFFTYDVAFLPDZ-UHFFFAOYSA-N
XLogP1.45
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(Trifluoromethyl)cyclohexa-2,4-dien-1-yl]pyrazol-3-amine
CID 66588278
1-(3,5-Difluorocyclohexa-1,5-dien-1-yl)pyrazol-3-amine
CID 70214179
1-(2-Fluorocyclohexa-1,5-dien-1-yl)pyrazol-3-amine
CID 70216304
1-[(3E)-5-fluoro-2-methylpenta-1,3-dien-3-yl]pyrazol-3-amine
CID 134596494
1-(3-fluoro-4-propan-2-ylcyclohexa-1,5-dien-1-yl)-N-methylpyrazol-3-amine
CID 135232912
1-(4-Ethyl-3-fluorocyclohexa-1,5-dien-1-yl)pyrazol-3-amine
CID 135232950
1-[(3E,5Z)-2-fluorohepta-1,3,5-trien-3-yl]pyrazol-3-amine
CID 142887935
1-[(3E)-6-methyl-5-(trifluoromethyl)hepta-1,3,5-trien-3-yl]pyrazol-3-amine
CID 143518768
1-(3-Fluoro-4-propan-2-ylcyclohexa-1,5-dien-1-yl)pyrazol-3-amine
CID 143818136
N-[(3E)-5-(2-fluoro-2-methylcyclopropyl)penta-1,3-dien-2-yl]-1-methylpyrazol-3-amine
CID 177342696
1-Cyclohexa-1,5-dien-1-ylpyrazol-3-amine
CID 53400251
1-(Cyclohexa-1,5-dien-1-ylmethyl)pyrazol-3-amine
CID 67934717

Frequently Asked Questions

What is the IUPAC name of 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine?
The IUPAC name of 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine (CID 143818183) is 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine?
The canonical SMILES for 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine is CC(C)C1C=CC(n2ccc(N)n2)=CN1.
What is the InChIKey of 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine?
The InChIKey is WGFFTYDVAFLPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-8(2)10-4-3-9(7-13-10)15-6-5-11(12)14-15/h3-8,10,13H,1-2H3,(H2,12,14).
What are the key properties of 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine?
1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine has a molecular weight of 204.28 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propan-2-yl-1,2-dihydropyridin-5-yl)pyrazol-3-amine is sourced from PubChem (CID 143818183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).