N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine

C13H10Cl2N6 — CID 133377216

IUPACN-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine
SMILESCc1ccnc(Nc2cnn(-c3ncc(Cl)cc3Cl)c2)n1
InChIInChI=1S/C13H10Cl2N6/c1-8-2-3-16-13(19-8)20-10-6-18-21(7-10)12-11(15)4-9(14)5-17-12/h2-7H,1H3,(H,16,19,20)
InChIKeyFTTINPXNCJRKOG-UHFFFAOYSA-N
MW321.17 g/mol
LogP3.42
Rot. Bonds3

About N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine

N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine (PubChem CID 133377216) has the molecular formula C13H10Cl2N6 and a molecular weight of 321.17 g/mol. Its IUPAC name is N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine
PubChem CID133377216
Molecular FormulaC13H10Cl2N6
Molecular Weight321.17 g/mol
Exact Mass320.03
IUPAC NameN-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine
SMILESCc1ccnc(Nc2cnn(-c3ncc(Cl)cc3Cl)c2)n1
InChIInChI=1S/C13H10Cl2N6/c1-8-2-3-16-13(19-8)20-10-6-18-21(7-10)12-11(15)4-9(14)5-17-12/h2-7H,1H3,(H,16,19,20)
InChIKeyFTTINPXNCJRKOG-UHFFFAOYSA-N
XLogP3.42
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]amino]-5,6-diethylpyridazine-4-carbonitrile
CID 133377207
N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-2-(difluoromethyl)quinazolin-4-amine
CID 133377215
N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine
CID 133304650
N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 133377232
4-methyl-N-(1-piperidin-4-ylpyrazol-4-yl)pyrimidin-2-amine
CID 134421040
N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-2-(1H-pyrazol-5-yl)acetamide
CID 166225847
3-amino-N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]butanamide;hydrochloride
CID 120873162
3-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-1-[(2S)-1-hydroxypropan-2-yl]-1-methylurea
CID 97341220
N-(1-tert-butylpyrazol-4-yl)-4-chloropyrimidin-2-amine
CID 152506703
4-methyl-N-(2-methylpyrazol-3-yl)pyrimidin-2-amine
CID 145343991
4-methyl-N-(3-methylphenyl)pyrimidin-2-amine
CID 12817737
N-(3-bromo-5-methylphenyl)-4-methylpyrimidin-2-amine
CID 67249356

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine?
The IUPAC name of N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine (CID 133377216) is N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine.
What is the SMILES notation for N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine?
The canonical SMILES for N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine is Cc1ccnc(Nc2cnn(-c3ncc(Cl)cc3Cl)c2)n1.
What is the InChIKey of N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine?
The InChIKey is FTTINPXNCJRKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N6/c1-8-2-3-16-13(19-8)20-10-6-18-21(7-10)12-11(15)4-9(14)5-17-12/h2-7H,1H3,(H,16,19,20).
What are the key properties of N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine?
N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine has a molecular weight of 321.17 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,5-dichloro-2-pyridinyl)pyrazol-4-yl]-4-methylpyrimidin-2-amine is sourced from PubChem (CID 133377216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).