1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide

C18H26N4O2 — CID 56806493

IUPAC1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1ccc(NC(=O)C2CCN(CN3C(=O)CCC3C)CC2)nc1
InChIInChI=1S/C18H26N4O2/c1-13-3-5-16(19-11-13)20-18(24)15-7-9-21(10-8-15)12-22-14(2)4-6-17(22)23/h3,5,11,14-15H,4,6-10,12H2,1-2H3,(H,19,20,24)
InChIKeyLRQBPKSIZZQOTN-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.01
Rot. Bonds4

About 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide

1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 56806493) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
PubChem CID56806493
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1ccc(NC(=O)C2CCN(CN3C(=O)CCC3C)CC2)nc1
InChIInChI=1S/C18H26N4O2/c1-13-3-5-16(19-11-13)20-18(24)15-7-9-21(10-8-15)12-22-14(2)4-6-17(22)23/h3,5,11,14-15H,4,6-10,12H2,1-2H3,(H,19,20,24)
InChIKeyLRQBPKSIZZQOTN-UHFFFAOYSA-N
XLogP2.01
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[4-(4-methylphenyl)-1-oxophthalazin-2-yl]methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55864204
1-[[3-(4-chlorophenyl)-4-methyl-2-oxoimidazol-1-yl]methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 56521996
N-(5-methyl-2-pyridinyl)-1-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]piperidine-4-carboxamide
CID 55865734
1-[(6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55865731
1-[(2-amino-1,3-thiazol-5-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 120898685
N-(5-methyl-2-pyridinyl)-1-[(3-methylpyrrolidin-3-yl)methyl]piperidine-4-carboxamide
CID 120898687
2-[4-[(5-methyl-2-pyridinyl)carbamoyl]piperidin-1-yl]propanoic acid
CID 119924327
trans-(1S,3S)-3-methyl-N-(5-methyl-2-pyridinyl)cyclopentane-1-carboxamide
CID 58763333
1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55922959
1-(6-methylpyridazin-3-yl)-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 121119029
1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55921660
1-[(3-hydroxy-4-methoxyphenyl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 154798177

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide (CID 56806493) is 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide is Cc1ccc(NC(=O)C2CCN(CN3C(=O)CCC3C)CC2)nc1.
What is the InChIKey of 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is LRQBPKSIZZQOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-13-3-5-16(19-11-13)20-18(24)15-7-9-21(10-8-15)12-22-14(2)4-6-17(22)23/h3,5,11,14-15H,4,6-10,12H2,1-2H3,(H,19,20,24).
What are the key properties of 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide?
1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methyl-5-oxopyrrolidin-1-yl)methyl]-N-(5-methyl-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 56806493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).