N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide

C15H18N4O — CID 106773929

IUPACN-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide
SMILESCC(NC(=O)c1cnc(NN)c2ccccc12)C1CC1
InChIInChI=1S/C15H18N4O/c1-9(10-6-7-10)18-15(20)13-8-17-14(19-16)12-5-3-2-4-11(12)13/h2-5,8-10H,6-7,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyYZHAYBKSYXVOID-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.05
Rot. Bonds4

About N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide

N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide (PubChem CID 106773929) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide
PubChem CID106773929
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide
SMILESCC(NC(=O)c1cnc(NN)c2ccccc12)C1CC1
InChIInChI=1S/C15H18N4O/c1-9(10-6-7-10)18-15(20)13-8-17-14(19-16)12-5-3-2-4-11(12)13/h2-5,8-10H,6-7,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyYZHAYBKSYXVOID-UHFFFAOYSA-N
XLogP2.05
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-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

1-hydrazinylisoquinoline-4-carbohydrazide
CID 165346130
5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242129
1-hydrazinyl-N-(2-propan-2-yloxyethyl)isoquinoline-4-carboxamide
CID 106774378
N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-3-carboxamide
CID 62242128
1-hydrazinyl-N-(3-methylcyclobutyl)isoquinoline-4-carboxamide
CID 106774391
5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62406728
2-(1-cyclopropylethylcarbamoyl)benzoic acid
CID 43533392
1-hydrazinyl-N-(2-methyltetrazol-5-yl)isoquinoline-4-carboxamide
CID 106774275
1-(ethylamino)-N-propan-2-ylisoquinoline-4-carboxamide
CID 106770073
(3,4-dihydroxypyrrolidin-1-yl)-(1-hydrazinylisoquinolin-4-yl)methanone
CID 106774564
N-ethyl-1-hydrazinyl-N-propan-2-ylisoquinoline-4-carboxamide
CID 106773895
(1-hydrazinylisoquinolin-4-yl)-(4-hydroxypiperidin-1-yl)methanone
CID 106773752

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide?
The IUPAC name of N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide (CID 106773929) is N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide?
The canonical SMILES for N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide is CC(NC(=O)c1cnc(NN)c2ccccc12)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide?
The InChIKey is YZHAYBKSYXVOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-9(10-6-7-10)18-15(20)13-8-17-14(19-16)12-5-3-2-4-11(12)13/h2-5,8-10H,6-7,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide?
N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide is sourced from PubChem (CID 106773929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).