N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide

C16H18N2O — CID 90162280

IUPACN-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide
SMILESCNC(=O)c1ccc(-c2cccnc2C(C)C)cc1
InChIInChI=1S/C16H18N2O/c1-11(2)15-14(5-4-10-18-15)12-6-8-13(9-7-12)16(19)17-3/h4-11H,1-3H3,(H,17,19)
InChIKeyZQSOZCVBDRQYET-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.23
Rot. Bonds3

About N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide

N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide (PubChem CID 90162280) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide
PubChem CID90162280
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide
SMILESCNC(=O)c1ccc(-c2cccnc2C(C)C)cc1
InChIInChI=1S/C16H18N2O/c1-11(2)15-14(5-4-10-18-15)12-6-8-13(9-7-12)16(19)17-3/h4-11H,1-3H3,(H,17,19)
InChIKeyZQSOZCVBDRQYET-UHFFFAOYSA-N
XLogP3.23
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-4-quinolin-5-ylbenzamide
CID 119066467
N-methyl-4-pyridin-2-ylbenzamide
CID 110464841
N-tert-butyl-3-(4-chlorophenyl)-5-(2-propan-2-yl-3-pyridinyl)benzamide
CID 126572774
4-(4-aminophenyl)-N-methylbenzamide
CID 91665695
1-N-methyl-4-N-pyridin-2-ylbenzene-1,4-dicarboxamide
CID 145416212
4-(4-amino-5-methyl-2-propan-2-ylphenyl)-N-methylbenzamide
CID 59586785
N,N-dimethyl-3-(2-propan-2-yl-3-pyridinyl)benzamide;N,N-dimethyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(4-ethyl-2-methylphenyl)-2-propan-2-ylpyridine;N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;3-(3-methylsulfonylphenyl)-2-propan-2-ylpyridine;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]ethanone;1-[3-(2-propan-2-yl-3-pyridinyl)phenyl]propan-1-one
CID 159258765
4-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[1-hydroxy-2-(5-hydroxy-1H-indol-3-yl)ethyl]amino]ethyl]-3-pyridinyl]-N-methylbenzamide
CID 135215849
2-[(4-hydroxybenzoyl)amino]-N-methylpyridine-3-carboxamide
CID 13072444
ethane;N-methylbenzamide;2-methylpropane
CID 161462553
2-methyl-1-(2-propan-2-yl-3-pyridinyl)propan-1-one
CID 176935005
4-[4-(dimethylamino)phenyl]-N-methylbenzamide
CID 110487764

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide?
The IUPAC name of N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide (CID 90162280) is N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide.
What is the SMILES notation for N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide?
The canonical SMILES for N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide is CNC(=O)c1ccc(-c2cccnc2C(C)C)cc1.
What is the InChIKey of N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide?
The InChIKey is ZQSOZCVBDRQYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11(2)15-14(5-4-10-18-15)12-6-8-13(9-7-12)16(19)17-3/h4-11H,1-3H3,(H,17,19).
What are the key properties of N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide?
N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide has a molecular weight of 254.33 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide is sourced from PubChem (CID 90162280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).