1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one

C22H24N4O3 — CID 69194008

IUPAC1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one
SMILESCC1(N)CCN(c2ccc(-n3ccc(OCc4ccccc4)cc3=O)c(=O)[nH]2)C1
InChIInChI=1S/C22H24N4O3/c1-22(23)10-12-25(15-22)19-8-7-18(21(28)24-19)26-11-9-17(13-20(26)27)29-14-16-5-3-2-4-6-16/h2-9,11,13H,10,12,14-15,23H2,1H3,(H,24,28)
InChIKeyIXSLUCJHIOJDCW-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.03
Rot. Bonds5

About 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one

1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one (PubChem CID 69194008) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one.

Molecular Properties

Compound Name1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one
PubChem CID69194008
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one
SMILESCC1(N)CCN(c2ccc(-n3ccc(OCc4ccccc4)cc3=O)c(=O)[nH]2)C1
InChIInChI=1S/C22H24N4O3/c1-22(23)10-12-25(15-22)19-8-7-18(21(28)24-19)26-11-9-17(13-20(26)27)29-14-16-5-3-2-4-6-16/h2-9,11,13H,10,12,14-15,23H2,1H3,(H,24,28)
InChIKeyIXSLUCJHIOJDCW-UHFFFAOYSA-N
XLogP2.03
TPSA93.35 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one with MolForge

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Related Compounds

9-[5-[4-[(5-chloro-2-pyridinyl)methoxy]-2-oxo-1-pyridinyl]-6-oxo-1H-pyridin-2-yl]-3,9-diazaspiro[5.5]undecane-2,4-dione
CID 66794226
1-[4-(2,9-diazaspiro[5.5]undecan-9-yl)phenyl]-4-phenylmethoxypyridin-2-one
CID 24951464
1-[4-(2-oxo-4-phenylmethoxy-1-pyridinyl)phenyl]piperidine-4-carboxamide
CID 24780737
1-[6-[(3S)-3-aminopyrrolidin-1-yl]-3-pyridinyl]-4-phenylmethoxypyridin-2-one
CID 24963342
1-(4-bromophenyl)-4-phenylmethoxypyridin-2-one
CID 59187025
4-phenylmethoxy-1-[4-(propylamino)phenyl]pyridin-2-one
CID 24780169
tert-butyl N-methyl-N-[3-methyl-1-[5-(2-oxo-4-phenylmethoxy-1-pyridinyl)-2-pyridinyl]pyrrolidin-3-yl]carbamate
CID 24967614
1-(4-iodo-3-methylphenyl)-4-phenylmethoxypyridin-2-one
CID 143591111
4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(3,6-diazabicyclo[3.2.0]heptan-3-yl)-2-oxo-1H-pyridin-3-yl]pyridin-2-one
CID 66823348
1-[6-[3-(methylamino)piperidin-1-yl]-3-pyridinyl]-4-phenylmethoxypyridin-2-one
CID 24968671
1-(2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)-4-phenylmethoxypyridin-2-one
CID 129143878
1-[4-(2,2-dimethylpropylamino)-3-methanimidoylphenyl]-4-phenylmethoxypyridin-2-one;propane
CID 143751108

Frequently Asked Questions

What is the IUPAC name of 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one?
The IUPAC name of 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one (CID 69194008) is 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one.
What is the SMILES notation for 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one?
The canonical SMILES for 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one is CC1(N)CCN(c2ccc(-n3ccc(OCc4ccccc4)cc3=O)c(=O)[nH]2)C1.
What is the InChIKey of 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one?
The InChIKey is IXSLUCJHIOJDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-22(23)10-12-25(15-22)19-8-7-18(21(28)24-19)26-11-9-17(13-20(26)27)29-14-16-5-3-2-4-6-16/h2-9,11,13H,10,12,14-15,23H2,1H3,(H,24,28).
What are the key properties of 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one?
1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one has a molecular weight of 392.46 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3-amino-3-methylpyrrolidin-1-yl)-2-oxo-1H-pyridin-3-yl]-4-phenylmethoxypyridin-2-one is sourced from PubChem (CID 69194008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).