N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride

C15H18ClN3O2 — CID 119614890

IUPACN-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride
SMILESCl.NCC(NC(=O)c1cc2ccccc2[nH]c1=O)C1CC1
InChIInChI=1S/C15H17N3O2.ClH/c16-8-13(9-5-6-9)18-15(20)11-7-10-3-1-2-4-12(10)17-14(11)19;/h1-4,7,9,13H,5-6,8,16H2,(H,17,19)(H,18,20);1H
InChIKeyOKBNSSTUYRFODA-UHFFFAOYSA-N
MW307.78 g/mol
LogP1.42
Rot. Bonds4

About N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride (PubChem CID 119614890) has the molecular formula C15H18ClN3O2 and a molecular weight of 307.78 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride
PubChem CID119614890
Molecular FormulaC15H18ClN3O2
Molecular Weight307.78 g/mol
Exact Mass307.11
IUPAC NameN-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride
SMILESCl.NCC(NC(=O)c1cc2ccccc2[nH]c1=O)C1CC1
InChIInChI=1S/C15H17N3O2.ClH/c16-8-13(9-5-6-9)18-15(20)11-7-10-3-1-2-4-12(10)17-14(11)19;/h1-4,7,9,13H,5-6,8,16H2,(H,17,19)(H,18,20);1H
InChIKeyOKBNSSTUYRFODA-UHFFFAOYSA-N
XLogP1.42
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.78
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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2-oxo-N-pentan-2-yl-1H-quinoline-3-carboxamide
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N-(2-amino-1-cyclopropylethyl)-2-fluorobenzamide
CID 65188796
2-oxo-N-(1-phenylethyl)-1H-quinoline-3-carboxamide
CID 16589971
N-(2-amino-1-cyclopropylethyl)-2-methylsulfanylbenzamide;hydrochloride
CID 119614072
N-cyclohexyl-2-oxo-1H-quinoline-3-carboxamide
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N-methyl-2-oxo-1H-quinoline-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride (CID 119614890) is N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride is Cl.NCC(NC(=O)c1cc2ccccc2[nH]c1=O)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride?
The InChIKey is OKBNSSTUYRFODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2.ClH/c16-8-13(9-5-6-9)18-15(20)11-7-10-3-1-2-4-12(10)17-14(11)19;/h1-4,7,9,13H,5-6,8,16H2,(H,17,19)(H,18,20);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride has a molecular weight of 307.78 g/mol, XLogP of 1.42, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride is sourced from PubChem (CID 119614890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).