2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide

C17H23N3O — CID 126607254

IUPAC2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESC=C1CCc2cc(C(=O)NC3CCN(C)CC3)ccc2N1
InChIInChI=1S/C17H23N3O/c1-12-3-4-13-11-14(5-6-16(13)18-12)17(21)19-15-7-9-20(2)10-8-15/h5-6,11,15,18H,1,3-4,7-10H2,2H3,(H,19,21)
InChIKeyFAQPYVHLEVKVCH-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.38
Rot. Bonds2

About 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide

2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide (PubChem CID 126607254) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide.

Molecular Properties

Compound Name2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide
PubChem CID126607254
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESC=C1CCc2cc(C(=O)NC3CCN(C)CC3)ccc2N1
InChIInChI=1S/C17H23N3O/c1-12-3-4-13-11-14(5-6-16(13)18-12)17(21)19-15-7-9-20(2)10-8-15/h5-6,11,15,18H,1,3-4,7-10H2,2H3,(H,19,21)
InChIKeyFAQPYVHLEVKVCH-UHFFFAOYSA-N
XLogP2.38
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 47116639
4-amino-3-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373277
4-carbamothioyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373646
4-amino-3-hydroxy-N-(1-methylpiperidin-4-yl)benzamide
CID 89070568
N-(4-hydroxycyclohexyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103605870
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
N-cyclopentyl-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxamide
CID 39896851
4-fluoro-N-(1-methylpyrrolidin-3-yl)benzamide
CID 47368477
N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
[4-[(1-methylpiperidin-4-yl)carbamoyl]phenyl]boronic acid
CID 140843225
4-acetamido-N-(1-methylpiperidin-4-yl)benzamide
CID 47114509
N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide
CID 62905083

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide?
The IUPAC name of 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide (CID 126607254) is 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide.
What is the SMILES notation for 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide?
The canonical SMILES for 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide is C=C1CCc2cc(C(=O)NC3CCN(C)CC3)ccc2N1.
What is the InChIKey of 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide?
The InChIKey is FAQPYVHLEVKVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-12-3-4-13-11-14(5-6-16(13)18-12)17(21)19-15-7-9-20(2)10-8-15/h5-6,11,15,18H,1,3-4,7-10H2,2H3,(H,19,21).
What are the key properties of 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide?
2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 2.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-N-(1-methylpiperidin-4-yl)-3,4-dihydro-1H-quinoline-6-carboxamide is sourced from PubChem (CID 126607254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).