N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide

C19H24N2O — CID 155185001

IUPACN-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide
SMILESCC(C)(C)Cc1ccc2ccc(NC(=O)C3CCC3)nc2c1
InChIInChI=1S/C19H24N2O/c1-19(2,3)12-13-7-8-14-9-10-17(20-16(14)11-13)21-18(22)15-5-4-6-15/h7-11,15H,4-6,12H2,1-3H3,(H,20,21,22)
InChIKeyNKSKNANHIVXHFF-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.56
Rot. Bonds3

About N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide

N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide (PubChem CID 155185001) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide
PubChem CID155185001
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide
SMILESCC(C)(C)Cc1ccc2ccc(NC(=O)C3CCC3)nc2c1
InChIInChI=1S/C19H24N2O/c1-19(2,3)12-13-7-8-14-9-10-17(20-16(14)11-13)21-18(22)15-5-4-6-15/h7-11,15H,4-6,12H2,1-3H3,(H,20,21,22)
InChIKeyNKSKNANHIVXHFF-UHFFFAOYSA-N
XLogP4.56
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-quinolin-2-ylcyclopentanecarboxamide
CID 39959364
N-[3-chloro-7-(2-methylpropyl)quinolin-2-yl]cyclobutanecarboxamide
CID 166882379
N-(5-iodo-6-methyl-2-pyridinyl)cyclobutanecarboxamide
CID 119042245
N-[6-(cyclohexanecarbonylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 5223932
N-[5-(butylamino)-2-pyridinyl]cyclobutanecarboxamide
CID 113024024
N-[5-methyl-7-(trifluoromethyl)-1,8-naphthyridin-2-yl]cyclohexanecarboxamide
CID 16667917
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113028301
N-(6-bromo-2-pyridinyl)-4-butylcyclohexane-1-carboxamide
CID 43520432
N-[4-(hydroxymethyl)phenyl]cyclobutanecarboxamide
CID 64792635
trans-methyl (1R,3R)-3-[(5-bromo-6-methyl-2-pyridinyl)carbamoyl]cyclohexane-1-carboxylate
CID 124608797
N-[5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113028985
2-(cyclobutanecarbonylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 66611880

Frequently Asked Questions

What is the IUPAC name of N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide?
The IUPAC name of N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide (CID 155185001) is N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide is CC(C)(C)Cc1ccc2ccc(NC(=O)C3CCC3)nc2c1.
What is the InChIKey of N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide?
The InChIKey is NKSKNANHIVXHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-19(2,3)12-13-7-8-14-9-10-17(20-16(14)11-13)21-18(22)15-5-4-6-15/h7-11,15H,4-6,12H2,1-3H3,(H,20,21,22).
What are the key properties of N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide?
N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide has a molecular weight of 296.41 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(2,2-dimethylpropyl)quinolin-2-yl]cyclobutanecarboxamide is sourced from PubChem (CID 155185001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).