6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine

C12H16N4 — CID 147423670

IUPAC6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine
SMILESCC1=C(Nc2ccn[nH]2)C=C(C2CC2)NC1
InChIInChI=1S/C12H16N4/c1-8-7-13-11(9-2-3-9)6-10(8)15-12-4-5-14-16-12/h4-6,9,13H,2-3,7H2,1H3,(H2,14,15,16)
InChIKeyDSZFVFPAYQSUKG-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.99
Rot. Bonds3

About 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine

6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine (PubChem CID 147423670) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine
PubChem CID147423670
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine
SMILESCC1=C(Nc2ccn[nH]2)C=C(C2CC2)NC1
InChIInChI=1S/C12H16N4/c1-8-7-13-11(9-2-3-9)6-10(8)15-12-4-5-14-16-12/h4-6,9,13H,2-3,7H2,1H3,(H2,14,15,16)
InChIKeyDSZFVFPAYQSUKG-UHFFFAOYSA-N
XLogP1.99
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluoro-1,5-dimethyl-2-propan-2-ylcyclohexa-2,4-dien-1-yl)-1H-pyrazol-5-amine
CID 175825076
Pyrazolyltetra-hydroindazole
CID 129815114
Pyrazolyltetrahydrocyclopentapyrazole
CID 129815125
N-(cyclopropylmethyl)-1H-pyrazol-5-amine
CID 55300847
N-(2-cyclohexa-1,3-dien-1-ylethyl)-4-methyl-1H-pyrazol-5-amine
CID 71277750
N-methyl-N'-(1H-pyrazol-5-yl)butane-1,4-diamine
CID 91550949
5-(2,5-dimethyl-2,3-dihydropyrrol-1-yl)-1H-pyrazole
CID 117624295
N-[(3E,5Z)-hepta-1,3,5-trien-3-yl]-1H-pyrazol-5-amine
CID 126714011
4-N-(1H-pyrazol-5-yl)-1,2-dihydropyridine-4,5-diamine
CID 129152816
4-[amino(1H-pyrazol-5-yl)amino]-1,2,3,6-tetrahydropyridin-5-amine
CID 129153187
2-methyl-4-N-(1H-pyrazol-5-yl)-1,2,3,6-tetrahydropyridine-4,5-diamine
CID 129153210
6-methyl-1-(1H-pyrazol-5-yl)-2,3,4,5,6,7-hexahydrotriazolo[4,5-c]pyridine
CID 132063069

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine?
The IUPAC name of 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine (CID 147423670) is 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine.
What is the SMILES notation for 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine?
The canonical SMILES for 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine is CC1=C(Nc2ccn[nH]2)C=C(C2CC2)NC1.
What is the InChIKey of 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine?
The InChIKey is DSZFVFPAYQSUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-8-7-13-11(9-2-3-9)6-10(8)15-12-4-5-14-16-12/h4-6,9,13H,2-3,7H2,1H3,(H2,14,15,16).
What are the key properties of 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine?
6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine has a molecular weight of 216.29 g/mol, XLogP of 1.99, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-methyl-N-(1H-pyrazol-5-yl)-1,2-dihydropyridin-4-amine is sourced from PubChem (CID 147423670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).