N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine

C14H13ClN4 — CID 46912329

IUPACN-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
SMILESCc1[nH]nc2ccnc(NCc3ccc(Cl)cc3)c12
InChIInChI=1S/C14H13ClN4/c1-9-13-12(19-18-9)6-7-16-14(13)17-8-10-2-4-11(15)5-3-10/h2-7H,8H2,1H3,(H,16,17)(H,18,19)
InChIKeyONQCVWNDKNOILT-UHFFFAOYSA-N
MW272.74 g/mol
LogP3.53
Rot. Bonds3

About N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine

N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine (PubChem CID 46912329) has the molecular formula C14H13ClN4 and a molecular weight of 272.74 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
PubChem CID46912329
Molecular FormulaC14H13ClN4
Molecular Weight272.74 g/mol
Exact Mass272.08
IUPAC NameN-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
SMILESCc1[nH]nc2ccnc(NCc3ccc(Cl)cc3)c12
InChIInChI=1S/C14H13ClN4/c1-9-13-12(19-18-9)6-7-16-14(13)17-8-10-2-4-11(15)5-3-10/h2-7H,8H2,1H3,(H,16,17)(H,18,19)
InChIKeyONQCVWNDKNOILT-UHFFFAOYSA-N
XLogP3.53
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-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

1-[3-(2-Methylpyridin-4-Yl)-1~{h}-Pyrazolo[4,3-C]pyridin-6-Yl]-3-(Phenylmethyl)urea
CID 71555247
N-[(4-Chlorophenyl)methyl]-1-Methyl-1h-Pyrazolo[3,4-D]pyrimidin-4-Amine
CID 228292
3-((3-Chlorophenyl)amino)-4-((3-methylphenyl)amino)-1H-pyrazolo[3,4-d]pyrimidine
CID 5327827
3-benzylamino-4-(3-chloro-phenylamino)-1H-pyrazolo[3,4-d]pyrimidine
CID 5327835
4-N-(3-chlorophenyl)-3-N-[(3-chlorophenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine
CID 5327836
3-(3-aminophenyl)-N-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 5327844
3-(4-aminophenyl)-N-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 5327846
4-Benzylamino-3-(3-chloro-phenylamino)-1H-pyrazolo[3,4-d]pyrimidine
CID 5327848
Pyrazine-Pyridine Biheteroaryl 57
CID 5330391
4-[2-(4-chlorophenyl)pyrazolo[1,5-b]pyridazin-3-yl]-N-phenylpyrimidin-2-amine
CID 6539424
Pyrazolo[1,5-b]pyridazine deriv. 84
CID 6539426
1-[5-(4-chlorophenyl)-4-(4-pyridinyl)-1H-pyrazol-3-yl]-3,5-dimethylpiperazine
CID 9842184

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
The IUPAC name of N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine (CID 46912329) is N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine is Cc1[nH]nc2ccnc(NCc3ccc(Cl)cc3)c12.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
The InChIKey is ONQCVWNDKNOILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN4/c1-9-13-12(19-18-9)6-7-16-14(13)17-8-10-2-4-11(15)5-3-10/h2-7H,8H2,1H3,(H,16,17)(H,18,19).
What are the key properties of N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine?
N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine has a molecular weight of 272.74 g/mol, XLogP of 3.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine is sourced from PubChem (CID 46912329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).