3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride

C19H26ClN3O2 — CID 119747301

IUPAC3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
SMILESCl.NC1C2CCC(C2)C1C(=O)NCC(=O)N1CCCc2ccccc21
InChIInChI=1S/C19H25N3O2.ClH/c20-18-14-8-7-13(10-14)17(18)19(24)21-11-16(23)22-9-3-5-12-4-1-2-6-15(12)22;/h1-2,4,6,13-14,17-18H,3,5,7-11,20H2,(H,21,24);1H
InChIKeyHBENCSOVGVJMBK-UHFFFAOYSA-N
MW363.89 g/mol
LogP1.88
Rot. Bonds3

About 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride

3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride (PubChem CID 119747301) has the molecular formula C19H26ClN3O2 and a molecular weight of 363.89 g/mol. Its IUPAC name is 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
PubChem CID119747301
Molecular FormulaC19H26ClN3O2
Molecular Weight363.89 g/mol
Exact Mass363.17
IUPAC Name3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
SMILESCl.NC1C2CCC(C2)C1C(=O)NCC(=O)N1CCCc2ccccc21
InChIInChI=1S/C19H25N3O2.ClH/c20-18-14-8-7-13(10-14)17(18)19(24)21-11-16(23)22-9-3-5-12-4-1-2-6-15(12)22;/h1-2,4,6,13-14,17-18H,3,5,7-11,20H2,(H,21,24);1H
InChIKeyHBENCSOVGVJMBK-UHFFFAOYSA-N
XLogP1.88
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.89
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride 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

4-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120673139
2-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]propanamide;hydrochloride
CID 119302463
2-(cyclopropylmethylamino)-1-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanone;hydrochloride
CID 119732412
N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-N'-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboximidamide
CID 109441773
1-[(2S,3R)-2-cyclopropyloxolan-3-yl]-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]urea
CID 124880619
N-[2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 47714484
N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-3,3-diphenylpropanamide
CID 99217097
7-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]heptanamide;hydrochloride
CID 119747287
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
CID 1439765
2-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-phenylpropanamide
CID 120590099
4-[[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]amino]methyl]benzoic acid
CID 122035247
N-[2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]amino]-2-oxoethyl]-2-phenylacetamide
CID 53125842

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride (CID 119747301) is 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride is Cl.NC1C2CCC(C2)C1C(=O)NCC(=O)N1CCCc2ccccc21.
What is the InChIKey of 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride?
The InChIKey is HBENCSOVGVJMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2.ClH/c20-18-14-8-7-13(10-14)17(18)19(24)21-11-16(23)22-9-3-5-12-4-1-2-6-15(12)22;/h1-2,4,6,13-14,17-18H,3,5,7-11,20H2,(H,21,24);1H.
What are the key properties of 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride?
3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride has a molecular weight of 363.89 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride is sourced from PubChem (CID 119747301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).