(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide

C19H22N2O2 — CID 9249756

IUPAC(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)[C@H](C)N2CCCc3ccccc32)cc1
InChIInChI=1S/C19H22N2O2/c1-14(19(22)20-16-9-11-17(23-2)12-10-16)21-13-5-7-15-6-3-4-8-18(15)21/h3-4,6,8-12,14H,5,7,13H2,1-2H3,(H,20,22)/t14-/m0/s1
InChIKeyRGFZGOCUVMNZKY-AWEZNQCLSA-N
MW310.40 g/mol
LogP3.47
Rot. Bonds4

About (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide

(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide (PubChem CID 9249756) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide
PubChem CID9249756
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)[C@H](C)N2CCCc3ccccc32)cc1
InChIInChI=1S/C19H22N2O2/c1-14(19(22)20-16-9-11-17(23-2)12-10-16)21-13-5-7-15-6-3-4-8-18(15)21/h3-4,6,8-12,14H,5,7,13H2,1-2H3,(H,20,22)/t14-/m0/s1
InChIKeyRGFZGOCUVMNZKY-AWEZNQCLSA-N
XLogP3.47
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-ethoxyphenyl)propanamide
CID 9249754
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)butanamide
CID 16576209
(2R)-2-(2,3-dihydroindol-1-yl)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 7998746
(2R)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(9,10-dioxoanthracen-2-yl)propanamide
CID 8686429
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 24506586
(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxy-5-methylphenyl)propanamide
CID 9249767
(2R)-2-(2,3-dihydroindol-1-yl)-N-(4-fluorophenyl)propanamide
CID 8704324
(2R)-N-(3-methoxyphenyl)-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 8593450
2,4-bis(3,4-dihydro-2H-quinolin-1-yl)pentan-3-one
CID 151944573
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide
CID 51242293
(2R)-2-(3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 42223767
(2R)-N-(3-chloro-2-methylphenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 9249760

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide?
The IUPAC name of (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide (CID 9249756) is (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide.
What is the SMILES notation for (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide?
The canonical SMILES for (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide is COc1ccc(NC(=O)[C@H](C)N2CCCc3ccccc32)cc1.
What is the InChIKey of (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide?
The InChIKey is RGFZGOCUVMNZKY-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14(19(22)20-16-9-11-17(23-2)12-10-16)21-13-5-7-15-6-3-4-8-18(15)21/h3-4,6,8-12,14H,5,7,13H2,1-2H3,(H,20,22)/t14-/m0/s1.
What are the key properties of (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide?
(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide has a molecular weight of 310.40 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 9249756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).