5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide

C22H24N6O2 — CID 127250654

IUPAC5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1ccc(-c2ccc(C3CN(c4nc(C)cc(C)n4)CCO3)nc2)cn1
InChIInChI=1S/C22H24N6O2/c1-14-10-15(2)27-22(26-14)28-8-9-30-20(13-28)18-6-4-16(11-24-18)17-5-7-19(25-12-17)21(29)23-3/h4-7,10-12,20H,8-9,13H2,1-3H3,(H,23,29)
InChIKeyNNCSWPNMWWSYEJ-UHFFFAOYSA-N
MW404.47 g/mol
LogP2.49
Rot. Bonds4

About 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide

5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide (PubChem CID 127250654) has the molecular formula C22H24N6O2 and a molecular weight of 404.47 g/mol. Its IUPAC name is 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
PubChem CID127250654
Molecular FormulaC22H24N6O2
Molecular Weight404.47 g/mol
Exact Mass404.20
IUPAC Name5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1ccc(-c2ccc(C3CN(c4nc(C)cc(C)n4)CCO3)nc2)cn1
InChIInChI=1S/C22H24N6O2/c1-14-10-15(2)27-22(26-14)28-8-9-30-20(13-28)18-6-4-16(11-24-18)17-5-7-19(25-12-17)21(29)23-3/h4-7,10-12,20H,8-9,13H2,1-3H3,(H,23,29)
InChIKeyNNCSWPNMWWSYEJ-UHFFFAOYSA-N
XLogP2.49
TPSA93.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[6-[(2R)-4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
CID 125013491
2-[(2S)-4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-N-methylquinoline-4-carboxamide
CID 92638338
N-methyl-5-[2-methyl-6-[(2S)-4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]-4-pyridinyl]pyridine-2-carboxamide
CID 124951336
N-methyl-5-[2-methyl-6-[4-[2-(methylamino)pyridine-4-carbonyl]morpholin-2-yl]-4-pyridinyl]pyridine-2-carboxamide
CID 110130769
4-[6-[(2R)-4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-2-pyridinyl]benzamide
CID 124963966
N-methyl-5-[2-methyl-6-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)morpholin-2-yl]-4-pyridinyl]pyridine-2-carboxamide
CID 127251364
4-(4,6-dimethylpyrimidin-2-yl)-2-pyrazin-2-ylmorpholine
CID 110103191
2-(2,6-dimethylpyrimidin-4-yl)-4-(4,6-dimethylpyrimidin-2-yl)morpholine
CID 110115953
3-[(2R)-4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-N-methylpyrazin-2-amine
CID 124958682
2-(4-bromophenyl)-4-(4,6-dimethylpyrimidin-2-yl)morpholine
CID 47983335
4-[(2R)-4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-2-methyl-1H-pyrimidin-6-one
CID 137090573
5-[6-[(2R)-4-[4-(methoxymethyl)benzoyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
CID 124973780

Frequently Asked Questions

What is the IUPAC name of 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide?
The IUPAC name of 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide (CID 127250654) is 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide is CNC(=O)c1ccc(-c2ccc(C3CN(c4nc(C)cc(C)n4)CCO3)nc2)cn1.
What is the InChIKey of 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide?
The InChIKey is NNCSWPNMWWSYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O2/c1-14-10-15(2)27-22(26-14)28-8-9-30-20(13-28)18-6-4-16(11-24-18)17-5-7-19(25-12-17)21(29)23-3/h4-7,10-12,20H,8-9,13H2,1-3H3,(H,23,29).
What are the key properties of 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide?
5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide has a molecular weight of 404.47 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 127250654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).