N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride

C17H24ClN3O2 — CID 119613182

IUPACN-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride
SMILESCl.NCC(NC(=O)CCN1C(=O)CCc2ccccc21)C1CC1
InChIInChI=1S/C17H23N3O2.ClH/c18-11-14(12-5-6-12)19-16(21)9-10-20-15-4-2-1-3-13(15)7-8-17(20)22;/h1-4,12,14H,5-11,18H2,(H,19,21);1H
InChIKeyHHJPZHSPIJMGKF-UHFFFAOYSA-N
MW337.85 g/mol
LogP1.63
Rot. Bonds6

About N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride (PubChem CID 119613182) has the molecular formula C17H24ClN3O2 and a molecular weight of 337.85 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride
PubChem CID119613182
Molecular FormulaC17H24ClN3O2
Molecular Weight337.85 g/mol
Exact Mass337.16
IUPAC NameN-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride
SMILESCl.NCC(NC(=O)CCN1C(=O)CCc2ccccc21)C1CC1
InChIInChI=1S/C17H23N3O2.ClH/c18-11-14(12-5-6-12)19-16(21)9-10-20-15-4-2-1-3-13(15)7-8-17(20)22;/h1-4,12,14H,5-11,18H2,(H,19,21);1H
InChIKeyHHJPZHSPIJMGKF-UHFFFAOYSA-N
XLogP1.63
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.85
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide;hydrochloride
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CID 119565152
(2S,3S)-3-methyl-2-[3-(2-oxo-3,4-dihydroquinolin-1-yl)propanoylamino]pentanoic acid
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N-(2-amino-2-phenylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide
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N-[2-(cycloheptylamino)ethyl]-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride
CID 119619374
methyl 3-(2-oxo-3,4-dihydroquinolin-1-yl)propanoate
CID 28940061
cis-(1R,3S)-3-[3-(2-oxo-3,4-dihydroquinolin-1-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 120678518
N-(2-methylpiperidin-3-yl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide
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3-(2-oxo-3,4-dihydroquinolin-1-yl)propanethioamide
CID 24704433
N-(2-amino-1-cyclopropylethyl)-3-[(2-oxo-3H-indol-1-yl)methyl]furan-2-carboxamide;hydrochloride
CID 119613935
1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 63915018
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride (CID 119613182) is N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride is Cl.NCC(NC(=O)CCN1C(=O)CCc2ccccc21)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride?
The InChIKey is HHJPZHSPIJMGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2.ClH/c18-11-14(12-5-6-12)19-16(21)9-10-20-15-4-2-1-3-13(15)7-8-17(20)22;/h1-4,12,14H,5-11,18H2,(H,19,21);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride has a molecular weight of 337.85 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride is sourced from PubChem (CID 119613182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).