N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide

C15H17N3O — CID 55172573

IUPACN-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide
SMILESCN(C(=O)c1ccc2ncccc2c1)C1CCNC1
InChIInChI=1S/C15H17N3O/c1-18(13-6-8-16-10-13)15(19)12-4-5-14-11(9-12)3-2-7-17-14/h2-5,7,9,13,16H,6,8,10H2,1H3
InChIKeyXBXDWZLBUBDWEO-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.67
Rot. Bonds2

About N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide

N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide (PubChem CID 55172573) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide.

Molecular Properties

Compound NameN-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide
PubChem CID55172573
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide
SMILESCN(C(=O)c1ccc2ncccc2c1)C1CCNC1
InChIInChI=1S/C15H17N3O/c1-18(13-6-8-16-10-13)15(19)12-4-5-14-11(9-12)3-2-7-17-14/h2-5,7,9,13,16H,6,8,10H2,1H3
InChIKeyXBXDWZLBUBDWEO-UHFFFAOYSA-N
XLogP1.67
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-N-[(3S)-pyrrolidin-3-yl]quinoline-6-carboxamide
CID 11426487
3-fluoro-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60805996
N-(2-methylpropyl)-N-piperidin-3-ylquinoline-6-carboxamide
CID 142975144
1-N,3-N-dimethyl-1-N-phenyl-3-N-pyrrolidin-3-ylbenzene-1,3-dicarboxamide
CID 119552240
N,3,4-trimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554368
N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
CID 119551120
3-methoxy-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60806673
N-[(3S)-pyrrolidin-3-yl]quinoline-6-carboxamide
CID 79688925
3-chloro-4-iodo-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 103806752
N,5-dimethyl-N-piperidin-4-yl-1-quinolin-6-yltriazole-4-carboxamide
CID 119441874
N-methyl-N-pyrrolidin-3-yl-3-(tetrazol-1-yl)benzamide
CID 119551937
7-chloro-N-methyl-N-pyrrolidin-3-ylquinoline-4-carboxamide
CID 138050895

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide?
The IUPAC name of N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide (CID 55172573) is N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide.
What is the SMILES notation for N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide?
The canonical SMILES for N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide is CN(C(=O)c1ccc2ncccc2c1)C1CCNC1.
What is the InChIKey of N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide?
The InChIKey is XBXDWZLBUBDWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-18(13-6-8-16-10-13)15(19)12-4-5-14-11(9-12)3-2-7-17-14/h2-5,7,9,13,16H,6,8,10H2,1H3.
What are the key properties of N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide?
N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-pyrrolidin-3-ylquinoline-6-carboxamide is sourced from PubChem (CID 55172573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).