N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide

C12H12N4O2 — CID 75514019

IUPACN-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2ccc(C)nc2)ncn1
InChIInChI=1S/C12H12N4O2/c1-8-3-4-9(6-13-8)12(17)16-10-5-11(18-2)15-7-14-10/h3-7H,1-2H3,(H,14,15,16,17)
InChIKeyWRCYBWQHOUWRIV-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.44
Rot. Bonds3

About N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide

N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide (PubChem CID 75514019) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide
PubChem CID75514019
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC NameN-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2ccc(C)nc2)ncn1
InChIInChI=1S/C12H12N4O2/c1-8-3-4-9(6-13-8)12(17)16-10-5-11(18-2)15-7-14-10/h3-7H,1-2H3,(H,14,15,16,17)
InChIKeyWRCYBWQHOUWRIV-UHFFFAOYSA-N
XLogP1.44
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-{2-[(Cyclopropylcarbonyl)amino]pyridin-4-Yl}-4-Methoxypyrimidine-5-Carboxamide
CID 91667414
7-Formyl-3,4-dihydro-N-(6-methoxy-4-pyrimidinyl)-1,8-naphthyridine-1(2h)-carboxamide
CID 118036941
[3-[6-[(4-Methoxy-2-pyridinyl)amino]-2-methylpyrimidin-4-yl]piperidin-1-yl]-phenylmethanone
CID 118725469
N-[1-(6-methoxypyrimidin-4-yl)piperidin-4-yl]-N-methyl-7-oxo-6-prop-2-enyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 121338401
Pyrimidine-4-carboxamide, 88
CID 44520970
5-[[4-[(4-Methoxy-2-pyridinyl)amino]-1-piperidinyl]carbonyl]-2-pyridinecarbonitrile
CID 56659435
2'-(Cyclopropanecarboxamido)-4-methoxy-[2,4'-bipyridine]-5-carboxamide
CID 118732146
8-(2-Aminoethyl)-6-(6-methoxy-3-pyridinyl)-4-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-7-one
CID 59258842
6-(6-Methoxy-3-pyridinyl)-4-methyl-2-(methylamino)-8-prop-2-enylpyrido[2,3-d]pyrimidin-7-one
CID 59258850
US11377438, Example 146
CID 146525710
N11-Ethyl-4-methoxy-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453336
2-chloro-N-[(4-chloro-6-methoxy-pyrimidin-2-yl)carbamothioyl]pyridine-3-carboxamide
CID 12155634

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide (CID 75514019) is N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide is COc1cc(NC(=O)c2ccc(C)nc2)ncn1.
What is the InChIKey of N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide?
The InChIKey is WRCYBWQHOUWRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c1-8-3-4-9(6-13-8)12(17)16-10-5-11(18-2)15-7-14-10/h3-7H,1-2H3,(H,14,15,16,17).
What are the key properties of N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide?
N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide has a molecular weight of 244.25 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 75514019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).