N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

C14H16N4O — CID 65260753

IUPACN-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
SMILESCn1ccc(NC(=O)C2CNCc3ccccc32)n1
InChIInChI=1S/C14H16N4O/c1-18-7-6-13(17-18)16-14(19)12-9-15-8-10-4-2-3-5-11(10)12/h2-7,12,15H,8-9H2,1H3,(H,16,17,19)
InChIKeyFDXUWOZGDFONPK-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.25
Rot. Bonds2

About N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide (PubChem CID 65260753) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
PubChem CID65260753
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
SMILESCn1ccc(NC(=O)C2CNCc3ccccc32)n1
InChIInChI=1S/C14H16N4O/c1-18-7-6-13(17-18)16-14(19)12-9-15-8-10-4-2-3-5-11(10)12/h2-7,12,15H,8-9H2,1H3,(H,16,17,19)
InChIKeyFDXUWOZGDFONPK-UHFFFAOYSA-N
XLogP1.25
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide 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

N-(1,3-dimethylpyrazol-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 102805529
(1-methylpyrazol-3-yl)-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanone
CID 103133164
N-(1-methylpyrazol-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65260797
N-(1,2-oxazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65262162
N-(1-phenyltriazol-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 167874848
N-(5-bromo-4-methyl-2-pyridinyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 79735984
N-(4-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65260610
N-(1-methylpyrazol-3-yl)cyclopropanecarboxamide
CID 19405001
(1-methylpyrazol-4-yl)-(1,2,3,4-tetrahydroisoquinolin-4-yl)methanone
CID 116573312
N-(1H-imidazol-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65262068
N-(3,4-dimethylphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65260503
N-(2-imidazol-1-ylethyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 65262248

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide?
The IUPAC name of N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide (CID 65260753) is N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide.
What is the SMILES notation for N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide?
The canonical SMILES for N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide is Cn1ccc(NC(=O)C2CNCc3ccccc32)n1.
What is the InChIKey of N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide?
The InChIKey is FDXUWOZGDFONPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-18-7-6-13(17-18)16-14(19)12-9-15-8-10-4-2-3-5-11(10)12/h2-7,12,15H,8-9H2,1H3,(H,16,17,19).
What are the key properties of N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide?
N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-3-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide is sourced from PubChem (CID 65260753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).