N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide

C17H19N3O3 — CID 37486176

IUPACN-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide
SMILESCOc1ncccc1CNC(=O)CNC(=O)Cc1ccccc1
InChIInChI=1S/C17H19N3O3/c1-23-17-14(8-5-9-18-17)11-19-16(22)12-20-15(21)10-13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,19,22)(H,20,21)
InChIKeyUGBDZGQYMLCCAT-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.07
Rot. Bonds7

About N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide

N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide (PubChem CID 37486176) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide
PubChem CID37486176
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC NameN-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide
SMILESCOc1ncccc1CNC(=O)CNC(=O)Cc1ccccc1
InChIInChI=1S/C17H19N3O3/c1-23-17-14(8-5-9-18-17)11-19-16(22)12-20-15(21)10-13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,19,22)(H,20,21)
InChIKeyUGBDZGQYMLCCAT-UHFFFAOYSA-N
XLogP1.07
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-butylphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
CID 37485449
4-hydroxy-N-[(2-methoxy-3-pyridinyl)methyl]butanamide
CID 79204552
2-amino-N-[(2-methoxy-3-pyridinyl)methyl]-3-phenylpropanamide
CID 60857697
3-(2-chlorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]propanamide
CID 38535689
3-(2-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]propanamide
CID 38534369
2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
CID 37485782
3-[(2-methoxy-3-pyridinyl)methylamino]-2-methyl-3-oxopropanoic acid
CID 114898125
2-amino-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 61213958
2-iodo-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 38533778
2-(2,6-dimethylphenoxy)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
CID 37486076
2-[2-[[(2-methoxy-3-pyridinyl)methylamino]methyl]phenyl]acetic acid
CID 115461656
1-[(4-methoxyphenyl)methyl]-3-[(2-methoxy-3-pyridinyl)methyl]urea
CID 53184866

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide (CID 37486176) is N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide is COc1ncccc1CNC(=O)CNC(=O)Cc1ccccc1.
What is the InChIKey of N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide?
The InChIKey is UGBDZGQYMLCCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-23-17-14(8-5-9-18-17)11-19-16(22)12-20-15(21)10-13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide?
N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide has a molecular weight of 313.36 g/mol, XLogP of 1.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide is sourced from PubChem (CID 37486176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).