N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide

C24H29N5O3 — CID 95834079

IUPACN-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(-c2ccc(C3CCN(C(=O)CC[C@H]4CCC(=O)N4)CC3)nc2)cn1
InChIInChI=1S/C24H29N5O3/c1-25-24(32)21-7-3-18(15-27-21)17-2-6-20(26-14-17)16-10-12-29(13-11-16)23(31)9-5-19-4-8-22(30)28-19/h2-3,6-7,14-16,19H,4-5,8-13H2,1H3,(H,25,32)(H,28,30)/t19-/m1/s1
InChIKeyQGVKQZJSMGJZJV-LJQANCHMSA-N
MW435.53 g/mol
LogP2.27
Rot. Bonds6

About N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide

N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide (PubChem CID 95834079) has the molecular formula C24H29N5O3 and a molecular weight of 435.53 g/mol. Its IUPAC name is N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide
PubChem CID95834079
Molecular FormulaC24H29N5O3
Molecular Weight435.53 g/mol
Exact Mass435.23
IUPAC NameN-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(-c2ccc(C3CCN(C(=O)CC[C@H]4CCC(=O)N4)CC3)nc2)cn1
InChIInChI=1S/C24H29N5O3/c1-25-24(32)21-7-3-18(15-27-21)17-2-6-20(26-14-17)16-10-12-29(13-11-16)23(31)9-5-19-4-8-22(30)28-19/h2-3,6-7,14-16,19H,4-5,8-13H2,1H3,(H,25,32)(H,28,30)/t19-/m1/s1
InChIKeyQGVKQZJSMGJZJV-LJQANCHMSA-N
XLogP2.27
TPSA104.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.53
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[6-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
CID 92615458
(5R)-5-[3-[4-[4-[(4-chlorophenyl)methyl]-6-methyl-2-pyridinyl]piperidin-1-yl]-3-oxopropyl]pyrrolidin-2-one
CID 95834027
5-[2-[(3R)-1-(3-methoxypropanoyl)piperidin-3-yl]-6-methyl-4-pyridinyl]-N-methylpyridine-2-carboxamide
CID 95813915
5-[2-[1-(3-methoxypropanoyl)piperidin-3-yl]-6-methyl-4-pyridinyl]-N-methylpyridine-2-carboxamide
CID 110252459
N-methyl-5-[6-(1-pyrazin-2-ylpyrrolidin-2-yl)-3-pyridinyl]pyridine-2-carboxamide
CID 110268509
5-[6-[(2R)-1-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]pyrrolidin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
CID 92617030
5-[6-[4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
CID 127250654
1-[4-(5-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]ethanone
CID 95834066
(5S)-5-[3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]pyrrolidin-2-one
CID 92613476
4-[6-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-3-pyridinyl]benzoic acid
CID 175660741
N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 92621748
1-[4-[5-(6-amino-3-pyridinyl)-2-pyridinyl]piperidin-1-yl]-2-[(4-methoxyphenyl)methyl-methylamino]ethanone
CID 92615506

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide (CID 95834079) is N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide is CNC(=O)c1ccc(-c2ccc(C3CCN(C(=O)CC[C@H]4CCC(=O)N4)CC3)nc2)cn1.
What is the InChIKey of N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide?
The InChIKey is QGVKQZJSMGJZJV-LJQANCHMSA-N. The full InChI is InChI=1S/C24H29N5O3/c1-25-24(32)21-7-3-18(15-27-21)17-2-6-20(26-14-17)16-10-12-29(13-11-16)23(31)9-5-19-4-8-22(30)28-19/h2-3,6-7,14-16,19H,4-5,8-13H2,1H3,(H,25,32)(H,28,30)/t19-/m1/s1.
What are the key properties of N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide?
N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide has a molecular weight of 435.53 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[6-[1-[3-[(2R)-5-oxopyrrolidin-2-yl]propanoyl]piperidin-4-yl]-3-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 95834079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).