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

C12H24N2O2 — CID 62837285

IUPAC3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide
SMILESCCNC(C)CC(=O)NCCC1CCCO1
InChIInChI=1S/C12H24N2O2/c1-3-13-10(2)9-12(15)14-7-6-11-5-4-8-16-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyAXGVYZRIWRLOHM-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.06
Rot. Bonds7

About 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide

3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide (PubChem CID 62837285) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide
PubChem CID62837285
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide
SMILESCCNC(C)CC(=O)NCCC1CCCO1
InChIInChI=1S/C12H24N2O2/c1-3-13-10(2)9-12(15)14-7-6-11-5-4-8-16-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyAXGVYZRIWRLOHM-UHFFFAOYSA-N
XLogP1.06
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylamino)-N-(oxan-2-ylmethyl)butanamide
CID 62832746
4-hydroxy-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 79192350
3-(ethylamino)-2-methyl-N-[2-(oxolan-2-yl)ethyl]propanamide
CID 62852036
2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 110731236
3-oxo-3-[2-(oxolan-2-yl)ethylamino]propanoic acid
CID 62230104
5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 82011608
2-bromo-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 62856863
methyl 4-oxo-4-[2-(oxolan-2-yl)ethylamino]butanoate
CID 110731234
methyl N-[2-(oxolan-2-yl)ethyl]carbamate
CID 110731266
3-(tert-butylamino)-N-[2-(oxolan-2-yl)ethyl]propanamide
CID 54917416
2,2-dimethyl-4-oxo-4-[2-(oxolan-2-yl)ethylamino]butanoic acid
CID 65302675
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 107569103

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide?
The IUPAC name of 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide (CID 62837285) is 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide.
What is the SMILES notation for 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide?
The canonical SMILES for 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide is CCNC(C)CC(=O)NCCC1CCCO1.
What is the InChIKey of 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide?
The InChIKey is AXGVYZRIWRLOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-13-10(2)9-12(15)14-7-6-11-5-4-8-16-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide?
3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide has a molecular weight of 228.34 g/mol, XLogP of 1.06, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide is sourced from PubChem (CID 62837285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).