1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide

C17H21N3O2 — CID 172900595

IUPAC1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide
SMILESCOc1ccc2c(C)cc(N3CCCC(C(N)=O)C3)nc2c1
InChIInChI=1S/C17H21N3O2/c1-11-8-16(20-7-3-4-12(10-20)17(18)21)19-15-9-13(22-2)5-6-14(11)15/h5-6,8-9,12H,3-4,7,10H2,1-2H3,(H2,18,21)
InChIKeyLINDXIIABDFXOQ-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.25
Rot. Bonds3

About 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide

1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide (PubChem CID 172900595) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide
PubChem CID172900595
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide
SMILESCOc1ccc2c(C)cc(N3CCCC(C(N)=O)C3)nc2c1
InChIInChI=1S/C17H21N3O2/c1-11-8-16(20-7-3-4-12(10-20)17(18)21)19-15-9-13(22-2)5-6-14(11)15/h5-6,8-9,12H,3-4,7,10H2,1-2H3,(H2,18,21)
InChIKeyLINDXIIABDFXOQ-UHFFFAOYSA-N
XLogP2.25
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 171691583
[1-(7-methoxy-4-methylquinolin-2-yl)azetidin-3-yl]-morpholin-4-ylmethanone
CID 163354868
N-[1-(7-methoxy-4-methylquinolin-2-yl)piperidin-3-yl]-1,5-dimethylpyrazole-3-carboxamide
CID 172903824
(3S,4R)-4-cyclopropyl-1-(7-methoxy-4-methylquinolin-2-yl)pyrrolidin-3-amine
CID 133130921
N-methyl-1-(4-methylquinolin-2-yl)piperidine-3-carboxamide
CID 166605152
7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride
CID 121237212
ethyl 1-(6-methoxy-4-methylquinolin-2-yl)piperidine-4-carboxylate
CID 2852074
1-(3-amino-5-methoxyphenyl)piperidine-3-carboxamide
CID 80726633
[(2S,6R)-2,6-dimethylmorpholin-4-yl]-[1-(7-methoxy-4-methylquinazolin-2-yl)piperidin-3-yl]methanone
CID 45185896
(3S,4S)-3-(cyclopropylmethyl)-4-hydroxy-1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxylic acid
CID 137340252
1-[4-(aminomethyl)-6-methyl-2-pyridinyl]piperidine-3-carboxamide
CID 114765128
1-[(3S)-1-[(3S)-1-(7-methoxy-4-methylquinazolin-2-yl)piperidine-3-carbonyl]piperidin-3-yl]propan-1-one
CID 42164315

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide (CID 172900595) is 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide is COc1ccc2c(C)cc(N3CCCC(C(N)=O)C3)nc2c1.
What is the InChIKey of 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide?
The InChIKey is LINDXIIABDFXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-11-8-16(20-7-3-4-12(10-20)17(18)21)19-15-9-13(22-2)5-6-14(11)15/h5-6,8-9,12H,3-4,7,10H2,1-2H3,(H2,18,21).
What are the key properties of 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide?
1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 172900595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).