N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide

C19H24N2O — CID 2098697

IUPACN-cycloheptyl-2,6-dimethylquinoline-4-carboxamide
SMILESCc1ccc2nc(C)cc(C(=O)NC3CCCCCC3)c2c1
InChIInChI=1S/C19H24N2O/c1-13-9-10-18-16(11-13)17(12-14(2)20-18)19(22)21-15-7-5-3-4-6-8-15/h9-12,15H,3-8H2,1-2H3,(H,21,22)
InChIKeyNEXUSMASVVARAQ-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.30
Rot. Bonds2

About N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide

N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide (PubChem CID 2098697) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-2,6-dimethylquinoline-4-carboxamide
PubChem CID2098697
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-cycloheptyl-2,6-dimethylquinoline-4-carboxamide
SMILESCc1ccc2nc(C)cc(C(=O)NC3CCCCCC3)c2c1
InChIInChI=1S/C19H24N2O/c1-13-9-10-18-16(11-13)17(12-14(2)20-18)19(22)21-15-7-5-3-4-6-8-15/h9-12,15H,3-8H2,1-2H3,(H,21,22)
InChIKeyNEXUSMASVVARAQ-UHFFFAOYSA-N
XLogP4.30
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 77992
N-(2-(Dimethylamino)ethyl)acridine-4-carboxamide
CID 107805
SB 222200
CID 6604009
((2R,4S)-2-Benzyl-4-((quinolin-4-ylmethyl)amino)piperidin-1-yl)(3,5-dimethylphenyl)methanone
CID 9869033
N-(3-(benzyl(methyl)amino)propyl)-9-chloro-5,6,7,8-tetrahydroacridine-2-carboxamide
CID 73349008
SB 414240
CID 9806459
9-amino-N-(3-(dimethylamino)propyl)acridine-4-carboxamide
CID 150238
2-phenyl-N-(1-phenylethyl)quinoline-4-carboxamide
CID 2849628
5-(3-Methyl-1-triazeno)imidazole-4-carboxamide
CID 44570859
SN-28049
CID 9862688
N-Phenyl-1,2,3,4-tetrahydro-9-acridinecarboxamide
CID 775717
N-(2-Chloroethyl)-2-quinolinecarboxamide
CID 2305179

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide?
The IUPAC name of N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide (CID 2098697) is N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide.
What is the SMILES notation for N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide?
The canonical SMILES for N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide is Cc1ccc2nc(C)cc(C(=O)NC3CCCCCC3)c2c1.
What is the InChIKey of N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide?
The InChIKey is NEXUSMASVVARAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13-9-10-18-16(11-13)17(12-14(2)20-18)19(22)21-15-7-5-3-4-6-8-15/h9-12,15H,3-8H2,1-2H3,(H,21,22).
What are the key properties of N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide?
N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide has a molecular weight of 296.41 g/mol, XLogP of 4.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2,6-dimethylquinoline-4-carboxamide is sourced from PubChem (CID 2098697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).