1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one

C16H20N4O2 — CID 127339699

IUPAC1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one
SMILESCn1cc(C2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cn1
InChIInChI=1S/C16H20N4O2/c1-18-10-13(3-4-15(18)21)16(22)20-7-5-12(6-8-20)14-9-17-19(2)11-14/h3-4,9-12H,5-8H2,1-2H3
InChIKeyYZPMMKQFQXAKPC-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.14
Rot. Bonds2

About 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one

1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one (PubChem CID 127339699) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one
PubChem CID127339699
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one
SMILESCn1cc(C2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cn1
InChIInChI=1S/C16H20N4O2/c1-18-10-13(3-4-15(18)21)16(22)20-7-5-12(6-8-20)14-9-17-19(2)11-14/h3-4,9-12H,5-8H2,1-2H3
InChIKeyYZPMMKQFQXAKPC-UHFFFAOYSA-N
XLogP1.14
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-5-[(4S)-4-methylazepane-1-carbonyl]pyridin-2-one
CID 95591235
3-cyclopropyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]-1H-benzimidazol-2-one
CID 166244271
[4-(1-methylpyrazol-4-yl)piperidin-1-yl]-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanone
CID 166211367
1-methyl-5-[4-[(1R)-1-pyrrolidin-1-ylethyl]piperidine-1-carbonyl]pyridin-2-one
CID 95873949
5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]thiophene-2-carbonitrile
CID 136512716
5-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 70717882
1-methyl-5-(4-methylsulfonylpiperazine-1-carbonyl)pyridin-2-one
CID 75461426
indolizin-2-yl-[3-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone
CID 126792701
5-[(3S)-3-[4-(dimethylamino)-6-methyl-2-pyridinyl]pyrrolidine-1-carbonyl]-1-methylpyridin-2-one
CID 124963837
1-methyl-5-[3-(6-methylpyrazin-2-yl)piperidine-1-carbonyl]pyridin-2-one
CID 110102509
1-(1-methylpyrazol-4-yl)-5-(4-pyrazol-1-ylpiperidine-1-carbonyl)pyridin-2-one
CID 139003452
N-[cyclobutyl(cyclopropyl)methyl]-4-(1-methylpyrazol-4-yl)piperidine-1-carboxamide
CID 128635077

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one?
The IUPAC name of 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one (CID 127339699) is 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one?
The canonical SMILES for 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one is Cn1cc(C2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cn1.
What is the InChIKey of 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one?
The InChIKey is YZPMMKQFQXAKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-18-10-13(3-4-15(18)21)16(22)20-7-5-12(6-8-20)14-9-17-19(2)11-14/h3-4,9-12H,5-8H2,1-2H3.
What are the key properties of 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one?
1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one has a molecular weight of 300.36 g/mol, XLogP of 1.14, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 127339699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).