N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine

C15H16N4O — CID 138692712

IUPACN-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine
SMILESCOc1ccc(CNc2ccnc3c(C)[nH]nc23)cc1
InChIInChI=1S/C15H16N4O/c1-10-14-15(19-18-10)13(7-8-16-14)17-9-11-3-5-12(20-2)6-4-11/h3-8H,9H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyMBSGLEOMLVIIBR-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.89
Rot. Bonds4

About N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine

N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine (PubChem CID 138692712) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine
PubChem CID138692712
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine
SMILESCOc1ccc(CNc2ccnc3c(C)[nH]nc23)cc1
InChIInChI=1S/C15H16N4O/c1-10-14-15(19-18-10)13(7-8-16-14)17-9-11-3-5-12(20-2)6-4-11/h3-8H,9H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyMBSGLEOMLVIIBR-UHFFFAOYSA-N
XLogP2.89
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-c]pyridin-4-amine
CID 168946264
N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine
CID 133466915
N-[(4-methoxyphenyl)methyl]-9H-pyrido[2,3-b]indol-4-amine
CID 135060180
4-ethoxy-N-[(4-methoxyphenyl)methyl]pyrimidin-2-amine
CID 112636470
N-[(4-fluorophenyl)methyl]-6-methoxyquinolin-4-amine
CID 166633819
2-N-[(4-methoxyphenyl)methyl]-4-N-[(4-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112890248
3-[(4-methoxyphenyl)methylamino]-1H-pyridazine-6-thione
CID 106523217
8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine
CID 178086355
N-[(4-methoxyphenyl)methyl]-7-methyl-6H-imidazo[4,5-f]quinolin-9-amine
CID 135818954
5-iodo-N-[(4-methoxyphenyl)methyl]pyrimidin-2-amine
CID 115620538
2,4-dimethoxy-N-[(4-methoxyphenyl)methyl]aniline
CID 18316983
2-chloro-N-[(4-methoxyphenyl)methyl]pteridin-4-amine
CID 82459612

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine (CID 138692712) is N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine is COc1ccc(CNc2ccnc3c(C)[nH]nc23)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine?
The InChIKey is MBSGLEOMLVIIBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-10-14-15(19-18-10)13(7-8-16-14)17-9-11-3-5-12(20-2)6-4-11/h3-8H,9H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine?
N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine has a molecular weight of 268.32 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine is sourced from PubChem (CID 138692712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).