3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide

C18H22N6O2 — CID 155316390

IUPAC3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide
SMILESCNC(=O)N1CCc2c(N)nn(C(=O)C3CCNc4ccccc43)c2C1
InChIInChI=1S/C18H22N6O2/c1-20-18(26)23-9-7-13-15(10-23)24(22-16(13)19)17(25)12-6-8-21-14-5-3-2-4-11(12)14/h2-5,12,21H,6-10H2,1H3,(H2,19,22)(H,20,26)
InChIKeyIRWSOJJHMJWWTP-UHFFFAOYSA-N
MW354.41 g/mol
LogP1.40
Rot. Bonds1

About 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide

3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide (PubChem CID 155316390) has the molecular formula C18H22N6O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide
PubChem CID155316390
Molecular FormulaC18H22N6O2
Molecular Weight354.41 g/mol
Exact Mass354.18
IUPAC Name3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide
SMILESCNC(=O)N1CCc2c(N)nn(C(=O)C3CCNc4ccccc43)c2C1
InChIInChI=1S/C18H22N6O2/c1-20-18(26)23-9-7-13-15(10-23)24(22-16(13)19)17(25)12-6-8-21-14-5-3-2-4-11(12)14/h2-5,12,21H,6-10H2,1H3,(H2,19,22)(H,20,26)
InChIKeyIRWSOJJHMJWWTP-UHFFFAOYSA-N
XLogP1.40
TPSA105.28 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide with MolForge

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Related Compounds

(3-amino-6-propan-2-ylsulfonyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-1-yl)-(6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 147732137
(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-1-yl)-(8-methoxy-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 155163300
(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-1-yl)-(2,2-dimethyl-3,4-dihydro-1H-quinolin-4-yl)methanone
CID 148714031
(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-2-yl)-[(4S)-8-chloro-1,2,3,4-tetrahydroquinolin-4-yl]methanone;bis((3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-2-yl)-(8-chloro-1,2,3,4-tetrahydroquinolin-4-yl)methanone);(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-1-yl)-(8-chloro-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 159155318
(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-(1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 106313883
(3-amino-4,5,6,7-tetrahydroindazol-1-yl)-(7-chloro-1,2,3,4-tetrahydroquinolin-4-yl)methanone;(3-amino-4,5,6,7-tetrahydroindazol-2-yl)-(7-chloro-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 158763929
(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-2-yl)-(6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)methanone;(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-1-yl)-(6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)methanone;6-fluoro-1,2,3,4-tetrahydroquinoline-4-carboxylic acid;6-methylsulfonyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-amine
CID 159292182
(3,4-dimethoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 103533053
(3-amino-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-2-yl)-(1,2,3,4-tetrahydro-1,7-naphthyridin-4-yl)methanone
CID 155330777
(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-2-yl)-(6-chloro-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 155163383
(3-amino-6-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-2-yl)-(6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 147872166
(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-2-yl)-(8-methoxy-1,2,3,4-tetrahydroquinolin-4-yl)methanone;(3-amino-6-methylsulfonyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-1-yl)-(8-methoxy-1,2,3,4-tetrahydroquinolin-4-yl)methanone;8-methoxy-1,2,3,4-tetrahydroquinoline-4-carboxylic acid;6-methylsulfonyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-amine
CID 161235447

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide?
The IUPAC name of 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide (CID 155316390) is 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide?
The canonical SMILES for 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide is CNC(=O)N1CCc2c(N)nn(C(=O)C3CCNc4ccccc43)c2C1.
What is the InChIKey of 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide?
The InChIKey is IRWSOJJHMJWWTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O2/c1-20-18(26)23-9-7-13-15(10-23)24(22-16(13)19)17(25)12-6-8-21-14-5-3-2-4-11(12)14/h2-5,12,21H,6-10H2,1H3,(H2,19,22)(H,20,26).
What are the key properties of 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide?
3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 1.40, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-1-(1,2,3,4-tetrahydroquinoline-4-carbonyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxamide is sourced from PubChem (CID 155316390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).