N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide

C14H16N4O — CID 65389150

IUPACN-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide
SMILESCc1nc(NC(=O)c2ccccc2)cc(N(C)C)n1
InChIInChI=1S/C14H16N4O/c1-10-15-12(9-13(16-10)18(2)3)17-14(19)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,15,16,17,19)
InChIKeyNHXUTYHYFMCOIM-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.10
Rot. Bonds3

About N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide

N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide (PubChem CID 65389150) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide
PubChem CID65389150
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide
SMILESCc1nc(NC(=O)c2ccccc2)cc(N(C)C)n1
InChIInChI=1S/C14H16N4O/c1-10-15-12(9-13(16-10)18(2)3)17-14(19)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,15,16,17,19)
InChIKeyNHXUTYHYFMCOIM-UHFFFAOYSA-N
XLogP2.10
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(diethylamino)-2-methylpyrimidin-4-yl]benzamide
CID 65389183
4-tert-butyl-N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]benzamide
CID 50748478
N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3-fluorobenzamide
CID 50748564
N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3-(tetrazol-1-yl)benzamide
CID 122296448
N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-5-fluoropyridine-3-carboxamide
CID 122296492
N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-4-phenylbutanamide
CID 122296273
N-[2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]ethyl]-3-fluorobenzamide
CID 50947862
N-[2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]ethyl]-4-fluorobenzamide
CID 56699285
[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]cyclohexyl]carbamic acid
CID 68977621
N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-2-methylpropanamide
CID 50748403
N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-2-phenylmethoxyacetamide
CID 122296431
N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 569560

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide?
The IUPAC name of N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide (CID 65389150) is N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide.
What is the SMILES notation for N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide?
The canonical SMILES for N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide is Cc1nc(NC(=O)c2ccccc2)cc(N(C)C)n1.
What is the InChIKey of N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide?
The InChIKey is NHXUTYHYFMCOIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-10-15-12(9-13(16-10)18(2)3)17-14(19)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,15,16,17,19).
What are the key properties of N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide?
N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide has a molecular weight of 256.31 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-2-methylpyrimidin-4-yl]benzamide is sourced from PubChem (CID 65389150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).