N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide

C17H15N3O — CID 966576

IUPACN-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide
SMILESCc1cc(C)nc(NC(=O)c2cccc3ccccc23)n1
InChIInChI=1S/C17H15N3O/c1-11-10-12(2)19-17(18-11)20-16(21)15-9-5-7-13-6-3-4-8-14(13)15/h3-10H,1-2H3,(H,18,19,20,21)
InChIKeyZEEIVMAMMOXHHH-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.50
Rot. Bonds2

About N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide

N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide (PubChem CID 966576) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide
PubChem CID966576
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide
SMILESCc1cc(C)nc(NC(=O)c2cccc3ccccc23)n1
InChIInChI=1S/C17H15N3O/c1-11-10-12(2)19-17(18-11)20-16(21)15-9-5-7-13-6-3-4-8-14(13)15/h3-10H,1-2H3,(H,18,19,20,21)
InChIKeyZEEIVMAMMOXHHH-UHFFFAOYSA-N
XLogP3.50
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,6-dimethylpyrimidin-2-yl)-1H-indole-4-carboxamide
CID 43582943
N-(4,6-dimethylpyrimidin-2-yl)-2-(trifluoromethyl)benzamide
CID 108808047
N-(4,6-dimethylpyrimidin-2-yl)-3-methoxynaphthalene-2-carboxamide
CID 802722
N-(2H-tetrazol-5-yl)naphthalene-1-carboxamide
CID 5100620
N-(4,6-dimethylpyrimidin-2-yl)-2,6-dihydroxybenzamide
CID 107688990
N-(4,6-dimethylpyrimidin-2-yl)-2-(ethylamino)-3-fluorobenzamide
CID 62649344
N-(2,5-dimethylphenyl)naphthalene-1-carboxamide
CID 1278696
N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide
CID 673887
N-[3-(naphthalene-1-carbonylamino)phenyl]pyridine-4-carboxamide
CID 55610557
N-(4,6-dimethylpyrimidin-2-yl)-5-methyl-1-phenylpyrazole-4-carboxamide
CID 108804181
N-(4,6-dimethylpyrimidin-2-yl)-2,6-difluorobenzamide
CID 3309967
N-(2-chloro-5-methyl-3-pyridinyl)naphthalene-1-carboxamide
CID 102979737

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide (CID 966576) is N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide is Cc1cc(C)nc(NC(=O)c2cccc3ccccc23)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide?
The InChIKey is ZEEIVMAMMOXHHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-11-10-12(2)19-17(18-11)20-16(21)15-9-5-7-13-6-3-4-8-14(13)15/h3-10H,1-2H3,(H,18,19,20,21).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide?
N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide is sourced from PubChem (CID 966576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).