3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide

C11H22N2O3 — CID 106101375

IUPAC3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide
SMILESCCNC(C)CC(=O)NCC1(O)CCOC1
InChIInChI=1S/C11H22N2O3/c1-3-12-9(2)6-10(14)13-7-11(15)4-5-16-8-11/h9,12,15H,3-8H2,1-2H3,(H,13,14)
InChIKeyWEACRPLQSBWBKZ-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.36
Rot. Bonds6

About 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide

3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide (PubChem CID 106101375) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide
PubChem CID106101375
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide
SMILESCCNC(C)CC(=O)NCC1(O)CCOC1
InChIInChI=1S/C11H22N2O3/c1-3-12-9(2)6-10(14)13-7-11(15)4-5-16-8-11/h9,12,15H,3-8H2,1-2H3,(H,13,14)
InChIKeyWEACRPLQSBWBKZ-UHFFFAOYSA-N
XLogP-0.36
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(ethylamino)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]butanamide
CID 65120418
ethyl 3-[(3-hydroxyoxolan-3-yl)methylamino]butanoate
CID 106100665
(3S)-3-(aminomethyl)-N-[(3-hydroxyoxolan-3-yl)methyl]-5-methylhexanamide
CID 106101380
N-[(3-hydroxyoxolan-3-yl)methyl]-2-propan-2-ylsulfanylacetamide
CID 103848866
3-amino-3-cyclopropyl-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 106101542
2-chloro-N-[(3-hydroxyoxolan-3-yl)methyl]acetamide
CID 106765719
N-[(3-hydroxyoxolan-3-yl)methyl]-3,3-dimethylbutanamide
CID 103849517
N-[(3-hydroxyoxolan-3-yl)methyl]-2-methylsulfanylacetamide
CID 103848673
2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 106101394
6-amino-4-ethyl-N-[(3-hydroxyoxolan-3-yl)methyl]hexanamide
CID 106101353
3-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-2-methylpropanamide
CID 106101303
(3R)-N-(4-fluorophenyl)-3-[[(3S)-3-hydroxyoxolan-3-yl]methylamino]butanamide
CID 97108242

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide?
The IUPAC name of 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide (CID 106101375) is 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide.
What is the SMILES notation for 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide?
The canonical SMILES for 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide is CCNC(C)CC(=O)NCC1(O)CCOC1.
What is the InChIKey of 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide?
The InChIKey is WEACRPLQSBWBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-3-12-9(2)6-10(14)13-7-11(15)4-5-16-8-11/h9,12,15H,3-8H2,1-2H3,(H,13,14).
What are the key properties of 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide?
3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide has a molecular weight of 230.31 g/mol, XLogP of -0.36, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[(3-hydroxyoxolan-3-yl)methyl]butanamide is sourced from PubChem (CID 106101375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).