(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine

C13H12N4 — CID 174683472

IUPAC(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine
SMILESNCc1ccc(-n2ncc3ccncc32)cc1
InChIInChI=1S/C13H12N4/c14-7-10-1-3-12(4-2-10)17-13-9-15-6-5-11(13)8-16-17/h1-6,8-9H,7,14H2
InChIKeyNCXFAIOXYMDPFL-UHFFFAOYSA-N
MW224.27 g/mol
LogP1.88
Rot. Bonds2

About (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine

(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine (PubChem CID 174683472) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine.

Molecular Properties

Compound Name(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine
PubChem CID174683472
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC Name(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine
SMILESNCc1ccc(-n2ncc3ccncc32)cc1
InChIInChI=1S/C13H12N4/c14-7-10-1-3-12(4-2-10)17-13-9-15-6-5-11(13)8-16-17/h1-6,8-9H,7,14H2
InChIKeyNCXFAIOXYMDPFL-UHFFFAOYSA-N
XLogP1.88
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methylpyrazolo[5,4-c]pyridine
CID 59421465
N-[[1-(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)triazol-4-yl]methyl]-2-(trifluoromethyl)pyridin-4-amine
CID 146291243
[1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methanamine
CID 115042606
4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol
CID 115043642
[1-[4-(trifluoromethyl)phenyl]pyrazolo[5,4-c]pyridin-3-yl]methanamine
CID 168830408
[4-(4-bromo-5-cyclopropylpyrazol-1-yl)phenyl]methanamine
CID 117471753
2-pyrazolo[5,4-c]pyridin-1-ylacetamide
CID 89216977
2-(3-indazol-1-ylphenyl)ethanamine
CID 63942339
2-(4-indazol-1-ylphenoxy)ethanamine
CID 82513930
1-propan-2-ylpyrazolo[5,4-c]pyridine
CID 122471541
(1-pyridin-4-ylpyrazol-4-yl)methanamine
CID 20983373
(4-indazol-1-yl-2-methylphenyl)methanamine
CID 55038931

Frequently Asked Questions

What is the IUPAC name of (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine?
The IUPAC name of (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine (CID 174683472) is (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine.
What is the SMILES notation for (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine?
The canonical SMILES for (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine is NCc1ccc(-n2ncc3ccncc32)cc1.
What is the InChIKey of (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine?
The InChIKey is NCXFAIOXYMDPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4/c14-7-10-1-3-12(4-2-10)17-13-9-15-6-5-11(13)8-16-17/h1-6,8-9H,7,14H2.
What are the key properties of (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine?
(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine has a molecular weight of 224.27 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine is sourced from PubChem (CID 174683472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).