1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide

C19H25N3O2 — CID 171691583

IUPAC1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1ccc2c(C)cc(N3CCC(C(=O)N(C)C)CC3)nc2c1
InChIInChI=1S/C19H25N3O2/c1-13-11-18(20-17-12-15(24-4)5-6-16(13)17)22-9-7-14(8-10-22)19(23)21(2)3/h5-6,11-12,14H,7-10H2,1-4H3
InChIKeyPKNIKVMEIJFUPS-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.86
Rot. Bonds3

About 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide

1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 171691583) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
PubChem CID171691583
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1ccc2c(C)cc(N3CCC(C(=O)N(C)C)CC3)nc2c1
InChIInChI=1S/C19H25N3O2/c1-13-11-18(20-17-12-15(24-4)5-6-16(13)17)22-9-7-14(8-10-22)19(23)21(2)3/h5-6,11-12,14H,7-10H2,1-4H3
InChIKeyPKNIKVMEIJFUPS-UHFFFAOYSA-N
XLogP2.86
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxamide
CID 172900595
ethyl 1-(6-methoxy-4-methylquinolin-2-yl)piperidine-4-carboxylate
CID 2852074
7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride
CID 121237212
[1-(7-methoxy-4-methylquinolin-2-yl)azetidin-3-yl]-morpholin-4-ylmethanone
CID 163354868
1-(7-methoxy-4-methylquinazolin-2-yl)piperidine-4-carboxylic acid
CID 118759012
(3S,4S)-3-(cyclopropylmethyl)-4-hydroxy-1-(7-methoxy-4-methylquinolin-2-yl)piperidine-3-carboxylic acid
CID 137340252
(3S,4R)-4-cyclopropyl-1-(7-methoxy-4-methylquinolin-2-yl)pyrrolidin-3-amine
CID 133130921
1-(6-methoxypyrimidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 171700843
4-methoxy-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]benzamide
CID 15987844
1-(7-bromoquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 171691601
N-[1-(7-methoxy-4-methylquinolin-2-yl)piperidin-3-yl]-1,5-dimethylpyrazole-3-carboxamide
CID 172903824
1-(4-methoxypyrimidin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 31968556

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide (CID 171691583) is 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide is COc1ccc2c(C)cc(N3CCC(C(=O)N(C)C)CC3)nc2c1.
What is the InChIKey of 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is PKNIKVMEIJFUPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-13-11-18(20-17-12-15(24-4)5-6-16(13)17)22-9-7-14(8-10-22)19(23)21(2)3/h5-6,11-12,14H,7-10H2,1-4H3.
What are the key properties of 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide?
1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxy-4-methylquinolin-2-yl)-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 171691583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).