7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide

C20H25N3O2 — CID 125139418

IUPAC7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide
SMILESCOc1ccccc1C[C@@H](C)Nc1ccc2c(c1)N(C(N)=O)CCC2
InChIInChI=1S/C20H25N3O2/c1-14(12-16-6-3-4-8-19(16)25-2)22-17-10-9-15-7-5-11-23(20(21)24)18(15)13-17/h3-4,6,8-10,13-14,22H,5,7,11-12H2,1-2H3,(H2,21,24)/t14-/m1/s1
InChIKeyRTRGRYYILNZRIC-CQSZACIVSA-N
MW339.44 g/mol
LogP3.57
Rot. Bonds5

About 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide

7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide (PubChem CID 125139418) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide.

Molecular Properties

Compound Name7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide
PubChem CID125139418
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide
SMILESCOc1ccccc1C[C@@H](C)Nc1ccc2c(c1)N(C(N)=O)CCC2
InChIInChI=1S/C20H25N3O2/c1-14(12-16-6-3-4-8-19(16)25-2)22-17-10-9-15-7-5-11-23(20(21)24)18(15)13-17/h3-4,6,8-10,13-14,22H,5,7,11-12H2,1-2H3,(H2,21,24)/t14-/m1/s1
InChIKeyRTRGRYYILNZRIC-CQSZACIVSA-N
XLogP3.57
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-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

7-[1-(2-methoxyphenyl)propan-2-ylamino]-3,4-dihydro-2H-quinoline-1-carboxamide
CID 122147225
2-(2-methoxyphenoxy)-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]acetamide
CID 7517535
N'-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-N-[2-(2-methoxyphenyl)ethyl]oxamide
CID 7586327
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-(2-methoxyphenoxy)acetamide
CID 7517220
1-(2-methoxyphenyl)propan-2-ylurea
CID 21433825
2,3-dimethoxy-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]benzamide
CID 7517455
2-(3,4-dimethoxyphenyl)-N-(1-propanoyl-3,4-dihydro-2H-quinolin-7-yl)acetamide
CID 16835104
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(2-methoxyphenyl)urea
CID 30372555
methyl (2S)-2-[1-(2-methoxyphenyl)propan-2-ylamino]propanoate
CID 43786749
methyl N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]carbamate
CID 7517544
1-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-1,4-dicarboxamide
CID 56798078
1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-methoxyphenoxy)propan-1-one
CID 4943207

Frequently Asked Questions

What is the IUPAC name of 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide?
The IUPAC name of 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide (CID 125139418) is 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide.
What is the SMILES notation for 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide?
The canonical SMILES for 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide is COc1ccccc1C[C@@H](C)Nc1ccc2c(c1)N(C(N)=O)CCC2.
What is the InChIKey of 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide?
The InChIKey is RTRGRYYILNZRIC-CQSZACIVSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-14(12-16-6-3-4-8-19(16)25-2)22-17-10-9-15-7-5-11-23(20(21)24)18(15)13-17/h3-4,6,8-10,13-14,22H,5,7,11-12H2,1-2H3,(H2,21,24)/t14-/m1/s1.
What are the key properties of 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide?
7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[(2R)-1-(2-methoxyphenyl)propan-2-yl]amino]-3,4-dihydro-2H-quinoline-1-carboxamide is sourced from PubChem (CID 125139418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).