N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide

C11H17NO3 — CID 99876283

IUPACN-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide
SMILESCCCC(=O)NC[C@H](OC)c1ccco1
InChIInChI=1S/C11H17NO3/c1-3-5-11(13)12-8-10(14-2)9-6-4-7-15-9/h4,6-7,10H,3,5,8H2,1-2H3,(H,12,13)/t10-/m0/s1
InChIKeyBPXGBHSHNYRAMX-JTQLQIEISA-N
MW211.26 g/mol
LogP1.88
Rot. Bonds6

About N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide

N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide (PubChem CID 99876283) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide.

Molecular Properties

Compound NameN-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide
PubChem CID99876283
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC NameN-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide
SMILESCCCC(=O)NC[C@H](OC)c1ccco1
InChIInChI=1S/C11H17NO3/c1-3-5-11(13)12-8-10(14-2)9-6-4-7-15-9/h4,6-7,10H,3,5,8H2,1-2H3,(H,12,13)/t10-/m0/s1
InChIKeyBPXGBHSHNYRAMX-JTQLQIEISA-N
XLogP1.88
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl N-[2-(furan-2-yl)-2-methoxyethyl]carbamate
CID 121145445
N-[2-(furan-2-yl)-2-methoxyethyl]-3-methylbutanamide
CID 121145448
N-[2-(furan-2-yl)-2-methoxyethyl]-2-(4-phenylphenyl)acetamide
CID 121145554
N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 26819488
N-[2-(furan-2-yl)-2-methoxyethyl]-4-methylbenzamide
CID 121145461
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 93157841
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 60636600
2,6-difluoro-N-[2-(furan-2-yl)-2-methoxyethyl]benzamide
CID 121145483
N-[2-(5-chlorothiophen-2-yl)-2-methoxyethyl]butanamide
CID 121180066
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]butanamide
CID 112503325
N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide
CID 7268311
2-ethoxy-N-[2-(furan-2-yl)-2-methoxyethyl]benzamide
CID 121145492

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide?
The IUPAC name of N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide (CID 99876283) is N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide.
What is the SMILES notation for N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide?
The canonical SMILES for N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide is CCCC(=O)NC[C@H](OC)c1ccco1.
What is the InChIKey of N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide?
The InChIKey is BPXGBHSHNYRAMX-JTQLQIEISA-N. The full InChI is InChI=1S/C11H17NO3/c1-3-5-11(13)12-8-10(14-2)9-6-4-7-15-9/h4,6-7,10H,3,5,8H2,1-2H3,(H,12,13)/t10-/m0/s1.
What are the key properties of N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide?
N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide has a molecular weight of 211.26 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide is sourced from PubChem (CID 99876283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).