(2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide

C16H25N3O2 — CID 126450999

IUPAC(2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide
SMILESCc1c[nH]c(CNC(=O)[C@H](C)CN2CCCC2)c(C)c1=O
InChIInChI=1S/C16H25N3O2/c1-11-8-17-14(13(3)15(11)20)9-18-16(21)12(2)10-19-6-4-5-7-19/h8,12H,4-7,9-10H2,1-3H3,(H,17,20)(H,18,21)/t12-/m1/s1
InChIKeyIUDPLQJNHQHQGK-GFCCVEGCSA-N
MW291.39 g/mol
LogP1.34
Rot. Bonds5

About (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide

(2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide (PubChem CID 126450999) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide
PubChem CID126450999
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name(2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide
SMILESCc1c[nH]c(CNC(=O)[C@H](C)CN2CCCC2)c(C)c1=O
InChIInChI=1S/C16H25N3O2/c1-11-8-17-14(13(3)15(11)20)9-18-16(21)12(2)10-19-6-4-5-7-19/h8,12H,4-7,9-10H2,1-3H3,(H,17,20)(H,18,21)/t12-/m1/s1
InChIKeyIUDPLQJNHQHQGK-GFCCVEGCSA-N
XLogP1.34
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide with MolForge

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Related Compounds

(2S)-N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide
CID 125438071
(2R)-N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide
CID 125438070
(2R)-N-[(2-amino-3-pyridinyl)methyl]-2-methyl-3-piperidin-1-ylpropanamide
CID 125442236
2-methyl-N-[(5-methylfuran-2-yl)methyl]-3-piperazin-1-ylpropanamide
CID 115189094
3-(azetidin-1-yl)-2-methylpropanehydrazide
CID 130548534
2-methyl-5-[(1-pyrrolidin-1-ylpropan-2-ylamino)methyl]-1H-pyridin-4-one
CID 114038762
(2S)-2-methyl-3-pyrrolidin-1-ylpropanoic acid
CID 51704154
(2R)-3-(azetidin-1-yl)-N-[2-(2-chloro-3-methylphenyl)propan-2-yl]-2-methylpropanamide
CID 166072080
6-methyl-4-oxo-N-(1-piperidin-1-ylpropan-2-yl)-1H-pyridine-3-carboxamide
CID 103717573
4-methyl-5-pyrrolidin-1-ylpent-1-en-3-one
CID 90939236
1-(4-chloro-2,3-dimethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-one
CID 14071351
N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47292410

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide (CID 126450999) is (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide is Cc1c[nH]c(CNC(=O)[C@H](C)CN2CCCC2)c(C)c1=O.
What is the InChIKey of (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide?
The InChIKey is IUDPLQJNHQHQGK-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-11-8-17-14(13(3)15(11)20)9-18-16(21)12(2)10-19-6-4-5-7-19/h8,12H,4-7,9-10H2,1-3H3,(H,17,20)(H,18,21)/t12-/m1/s1.
What are the key properties of (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide?
(2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide has a molecular weight of 291.39 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 126450999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).