2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide

C12H23NO2 — CID 110731236

IUPAC2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide
SMILESCCC(CC)C(=O)NCCC1CCCO1
InChIInChI=1S/C12H23NO2/c1-3-10(4-2)12(14)13-8-7-11-6-5-9-15-11/h10-11H,3-9H2,1-2H3,(H,13,14)
InChIKeyRTMTYEFCSFCCBE-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.11
Rot. Bonds6

About 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide

2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide (PubChem CID 110731236) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide
PubChem CID110731236
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide
SMILESCCC(CC)C(=O)NCCC1CCCO1
InChIInChI=1S/C12H23NO2/c1-3-10(4-2)12(14)13-8-7-11-6-5-9-15-11/h10-11H,3-9H2,1-2H3,(H,13,14)
InChIKeyRTMTYEFCSFCCBE-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 62856863
2-ethyl-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]butanamide
CID 112991314
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 107569103
3-(ethylamino)-2-methyl-N-[2-(oxolan-2-yl)ethyl]propanamide
CID 62852036
(2R)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 103794477
methyl N-[2-(oxolan-2-yl)ethyl]carbamate
CID 110731266
(3S)-3-amino-4-oxo-4-[2-(oxolan-2-yl)ethylamino]butanoic acid
CID 67894474
2-ethyl-N-[2-[methylsulfonyl(oxolan-2-ylmethyl)amino]ethyl]butanamide
CID 113066137
2-ethyl-4-(oxolan-2-yl)butanoic acid
CID 65161630
2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide
CID 81089453
4-hydroxy-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 79192350
3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 62837285

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide?
The IUPAC name of 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide (CID 110731236) is 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide?
The canonical SMILES for 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide is CCC(CC)C(=O)NCCC1CCCO1.
What is the InChIKey of 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide?
The InChIKey is RTMTYEFCSFCCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-10(4-2)12(14)13-8-7-11-6-5-9-15-11/h10-11H,3-9H2,1-2H3,(H,13,14).
What are the key properties of 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide?
2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide has a molecular weight of 213.32 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide is sourced from PubChem (CID 110731236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).