7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide

C16H20N2O2 — CID 17425471

IUPAC7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NCC(C)C)c(C)nc2c1
InChIInChI=1S/C16H20N2O2/c1-10(2)9-17-16(19)14-7-12-5-6-13(20-4)8-15(12)18-11(14)3/h5-8,10H,9H2,1-4H3,(H,17,19)
InChIKeyLERASIVYZQYLRY-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.94
Rot. Bonds4

About 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide

7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide (PubChem CID 17425471) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide
PubChem CID17425471
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NCC(C)C)c(C)nc2c1
InChIInChI=1S/C16H20N2O2/c1-10(2)9-17-16(19)14-7-12-5-6-13(20-4)8-15(12)18-11(14)3/h5-8,10H,9H2,1-4H3,(H,17,19)
InChIKeyLERASIVYZQYLRY-UHFFFAOYSA-N
XLogP2.94
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxypropyl)-7-methoxy-2-methylquinoline-3-carboxamide
CID 78856115
3-[(7-methoxy-2-methylquinoline-3-carbonyl)amino]-2-methylpropanoic acid
CID 120525822
N-[(2R)-2-(ethylamino)propyl]-7-methoxy-2-methylquinoline-3-carboxamide
CID 120653655
N-(3-hydroxypropyl)-7-methoxy-2-methylquinoline-3-carboxamide
CID 78854787
(2S)-2-[[2-[(7-methoxy-2-methylquinoline-3-carbonyl)amino]acetyl]amino]-4-methylpentanoic acid
CID 120694929
7-methoxy-2-methyl-N-pentan-3-ylquinoline-3-carboxamide
CID 78829924
7-methoxy-2-methyl-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide
CID 17397255
N-ethoxy-7-methoxy-2-methylquinoline-3-carboxamide
CID 18169112
7-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide
CID 110489915
7-methoxy-2-methyl-N-[4-(4-methylphenoxy)butyl]quinoline-3-carboxamide
CID 55868189
N-[2-[(3-fluoro-4-methylbenzoyl)amino]ethyl]-7-methoxy-2-methylquinoline-3-carboxamide
CID 33323552
7-methoxy-2-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]quinoline-3-carboxamide
CID 51277603

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide?
The IUPAC name of 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide (CID 17425471) is 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide.
What is the SMILES notation for 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide?
The canonical SMILES for 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide is COc1ccc2cc(C(=O)NCC(C)C)c(C)nc2c1.
What is the InChIKey of 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide?
The InChIKey is LERASIVYZQYLRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-10(2)9-17-16(19)14-7-12-5-6-13(20-4)8-15(12)18-11(14)3/h5-8,10H,9H2,1-4H3,(H,17,19).
What are the key properties of 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide?
7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-methyl-N-(2-methylpropyl)quinoline-3-carboxamide is sourced from PubChem (CID 17425471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).