6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one

C13H14N4O2 — CID 141413691

IUPAC6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
SMILESCOc1ccc(-n2ncc3c2C(=O)N(N)CC3)cc1
InChIInChI=1S/C13H14N4O2/c1-19-11-4-2-10(3-5-11)17-12-9(8-15-17)6-7-16(14)13(12)18/h2-5,8H,6-7,14H2,1H3
InChIKeyDNNMQHXSBXZZGP-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.75
Rot. Bonds2

About 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one

6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one (PubChem CID 141413691) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one.

Molecular Properties

Compound Name6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
PubChem CID141413691
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
SMILESCOc1ccc(-n2ncc3c2C(=O)N(N)CC3)cc1
InChIInChI=1S/C13H14N4O2/c1-19-11-4-2-10(3-5-11)17-12-9(8-15-17)6-7-16(14)13(12)18/h2-5,8H,6-7,14H2,1H3
InChIKeyDNNMQHXSBXZZGP-UHFFFAOYSA-N
XLogP0.75
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

1-(4-methoxyphenyl)-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
CID 10273395
6-[4-[2-[[3-aminopropyl(methyl)amino]methyl]phenyl]phenyl]-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
CID 10152271
7-methoxy-1-phenyl-4,5-dihydrobenzo[g]indazole
CID 11425868
1-(4-methoxyphenyl)-5,6-dihydro-4H-pyrrolo[3,4-d]pyrazole
CID 83886668
1-(4-methoxyphenyl)-4-methyltetrazol-5-one
CID 139194376
1-[1-(4-methoxyphenyl)-4,6,7,8-tetrahydropyrazolo[4,5-c]azepin-5-yl]ethanone
CID 95857400
3-(4-methoxyphenyl)-11-methyl-8-thia-3,4,10-triazatricyclo[7.4.0.02,6]trideca-1(9),2(6),4,10,12-pentaene
CID 11174333
4-methoxy-1-(4-methoxyphenyl)pyrazole-5-carboxylic acid
CID 117233112
5-chloro-4-(4-methoxyphenoxy)-2-(4-methoxyphenyl)pyridazin-3-one
CID 50904469
5-ethyl-1-(4-methoxyphenyl)pyrazol-4-amine
CID 66441037
4-[4-cyano-5-(4-methoxyphenyl)pyrazol-1-yl]benzenesulfonamide
CID 22315541
5-cyclopropyl-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid
CID 63173747

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one?
The IUPAC name of 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one (CID 141413691) is 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one.
What is the SMILES notation for 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one?
The canonical SMILES for 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one is COc1ccc(-n2ncc3c2C(=O)N(N)CC3)cc1.
What is the InChIKey of 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one?
The InChIKey is DNNMQHXSBXZZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-19-11-4-2-10(3-5-11)17-12-9(8-15-17)6-7-16(14)13(12)18/h2-5,8H,6-7,14H2,1H3.
What are the key properties of 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one?
6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one has a molecular weight of 258.28 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one is sourced from PubChem (CID 141413691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).