1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide

C15H23N3O2 — CID 97244814

IUPAC1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide
SMILESC[C@H]1CCCN(CCNC(=O)c2cccc(=O)n2C)C1
InChIInChI=1S/C15H23N3O2/c1-12-5-4-9-18(11-12)10-8-16-15(20)13-6-3-7-14(19)17(13)2/h3,6-7,12H,4-5,8-11H2,1-2H3,(H,16,20)/t12-/m0/s1
InChIKeyPODCCUHILFWNBO-LBPRGKRZSA-N
MW277.37 g/mol
LogP0.85
Rot. Bonds4

About 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide

1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide (PubChem CID 97244814) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide
PubChem CID97244814
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide
SMILESC[C@H]1CCCN(CCNC(=O)c2cccc(=O)n2C)C1
InChIInChI=1S/C15H23N3O2/c1-12-5-4-9-18(11-12)10-8-16-15(20)13-6-3-7-14(19)17(13)2/h3,6-7,12H,4-5,8-11H2,1-2H3,(H,16,20)/t12-/m0/s1
InChIKeyPODCCUHILFWNBO-LBPRGKRZSA-N
XLogP0.85
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 47035917
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N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 94115500
2-(4-fluorophenyl)-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide
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4-fluoro-3-methyl-N-[2-(3-methylpiperidin-1-yl)ethyl]-1-benzothiophene-2-carboxamide
CID 55715502
N-[2-(3-methylpiperidin-1-yl)ethyl]pyrazine-2-carboxamide
CID 47035916
3-(2-methyloxetan-2-yl)-N-[2-(3-methylpiperidin-1-yl)ethyl]benzamide
CID 146142260
3-hydroxy-N-[2-(3-methylpiperidin-1-yl)ethyl]-3-phenylbutanamide
CID 110024824
4-(cyclopropylcarbamoylamino)-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]benzamide
CID 94611653
(2S)-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-2-pyrazol-1-ylpropanamide
CID 98752523
2-chloro-6-methyl-N-[2-[(3R)-3-methylpyrrolidin-1-yl]ethyl]benzamide
CID 126724124
N-[2-[3-(hydroxymethyl)piperidin-1-yl]ethyl]-1,3-dimethyl-2,6-dioxopyrimidine-4-carboxamide
CID 74241302

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide?
The IUPAC name of 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide (CID 97244814) is 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide?
The canonical SMILES for 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide is C[C@H]1CCCN(CCNC(=O)c2cccc(=O)n2C)C1.
What is the InChIKey of 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide?
The InChIKey is PODCCUHILFWNBO-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12-5-4-9-18(11-12)10-8-16-15(20)13-6-3-7-14(19)17(13)2/h3,6-7,12H,4-5,8-11H2,1-2H3,(H,16,20)/t12-/m0/s1.
What are the key properties of 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide?
1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]-6-oxopyridine-2-carboxamide is sourced from PubChem (CID 97244814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).