N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide

C18H23N3O4 — CID 87050468

IUPACN-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide
SMILESCCCC(=O)Nc1ccc(C)n(CC(=O)NCc2ccc(C)o2)c1=O
InChIInChI=1S/C18H23N3O4/c1-4-5-16(22)20-15-9-6-12(2)21(18(15)24)11-17(23)19-10-14-8-7-13(3)25-14/h6-9H,4-5,10-11H2,1-3H3,(H,19,23)(H,20,22)
InChIKeyBHGZEQZKJNRTBW-UHFFFAOYSA-N
MW345.40 g/mol
LogP2.11
Rot. Bonds7

About N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide

N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide (PubChem CID 87050468) has the molecular formula C18H23N3O4 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide.

Molecular Properties

Compound NameN-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide
PubChem CID87050468
Molecular FormulaC18H23N3O4
Molecular Weight345.40 g/mol
Exact Mass345.17
IUPAC NameN-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide
SMILESCCCC(=O)Nc1ccc(C)n(CC(=O)NCc2ccc(C)o2)c1=O
InChIInChI=1S/C18H23N3O4/c1-4-5-16(22)20-15-9-6-12(2)21(18(15)24)11-17(23)19-10-14-8-7-13(3)25-14/h6-9H,4-5,10-11H2,1-3H3,(H,19,23)(H,20,22)
InChIKeyBHGZEQZKJNRTBW-UHFFFAOYSA-N
XLogP2.11
TPSA93.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide with MolForge

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Related Compounds

4-methyl-N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide
CID 87050548
N-[6-methyl-1-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide
CID 87050459
N-[6-methyl-1-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]propanamide
CID 87050383
2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 87050347
N-[1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-6-methyl-2-oxo-3-pyridinyl]propanamide
CID 87050426
3-(ethylamino)-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 62834819
2-(4-benzyl-2,3-dioxoquinoxalin-1-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 46357271
2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-[(2-ethoxyphenyl)methyl]acetamide
CID 87050373
N-[(4-chlorophenyl)methyl]-2-[6-methyl-3-(methylcarbamoylamino)-2-oxo-1-pyridinyl]acetamide
CID 87050566
2-(3-aminopyrazol-1-yl)-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 62522791
2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-[(3-bromophenyl)methyl]acetamide
CID 87050372
4-chloro-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 63308436

Frequently Asked Questions

What is the IUPAC name of N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide?
The IUPAC name of N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide (CID 87050468) is N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide.
What is the SMILES notation for N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide?
The canonical SMILES for N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide is CCCC(=O)Nc1ccc(C)n(CC(=O)NCc2ccc(C)o2)c1=O.
What is the InChIKey of N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide?
The InChIKey is BHGZEQZKJNRTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4/c1-4-5-16(22)20-15-9-6-12(2)21(18(15)24)11-17(23)19-10-14-8-7-13(3)25-14/h6-9H,4-5,10-11H2,1-3H3,(H,19,23)(H,20,22).
What are the key properties of N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide?
N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide has a molecular weight of 345.40 g/mol, XLogP of 2.11, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-methyl-1-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]-2-oxo-3-pyridinyl]butanamide is sourced from PubChem (CID 87050468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).