2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide

C10H19N3O3 — CID 60848182

IUPAC2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide
SMILESCC(NC(=O)C(N)CC(N)=O)C1CCCO1
InChIInChI=1S/C10H19N3O3/c1-6(8-3-2-4-16-8)13-10(15)7(11)5-9(12)14/h6-8H,2-5,11H2,1H3,(H2,12,14)(H,13,15)
InChIKeyHBHOIIOUZOBXNA-UHFFFAOYSA-N
MW229.28 g/mol
LogP-1.13
Rot. Bonds5

About 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide

2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide (PubChem CID 60848182) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide.

Molecular Properties

Compound Name2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide
PubChem CID60848182
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide
SMILESCC(NC(=O)C(N)CC(N)=O)C1CCCO1
InChIInChI=1S/C10H19N3O3/c1-6(8-3-2-4-16-8)13-10(15)7(11)5-9(12)14/h6-8H,2-5,11H2,1H3,(H2,12,14)(H,13,15)
InChIKeyHBHOIIOUZOBXNA-UHFFFAOYSA-N
XLogP-1.13
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3S)-2-amino-3-methyl-N-[1-(oxolan-2-yl)ethyl]pentanamide
CID 61155055
(2R)-2-amino-N-[1-(oxolan-2-yl)ethyl]-3-phenylpropanamide
CID 78985428
(2R)-2-amino-3-(4-hydroxyphenyl)-N-[1-(oxolan-2-yl)ethyl]propanamide
CID 104904745
2-amino-N-[1-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 114925311
4-amino-2-methyl-N-[1-(oxolan-2-yl)ethyl]butanamide
CID 80542445
2-(N'-hydroxycarbamimidoyl)-N-[1-(oxolan-2-yl)ethyl]pentanamide
CID 76924918
1-(oxolan-2-yl)ethylthiourea
CID 43533883
2-hydroxy-N-[1-(oxan-2-yl)ethyl]acetamide
CID 130749825
ethyl 2-oxo-2-[1-(oxolan-2-yl)ethylamino]acetate
CID 60895927
N-[1-(oxolan-2-yl)ethyl]cyclopropanecarboxamide
CID 17330465
2-amino-N-[1-(oxolan-2-yl)ethyl]-2-phenylacetamide;hydrochloride
CID 119292175
1-[(1-hydroxycyclobutyl)methyl]-3-[1-(oxolan-2-yl)ethyl]urea
CID 111438268

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide?
The IUPAC name of 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide (CID 60848182) is 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide.
What is the SMILES notation for 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide?
The canonical SMILES for 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide is CC(NC(=O)C(N)CC(N)=O)C1CCCO1.
What is the InChIKey of 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide?
The InChIKey is HBHOIIOUZOBXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-6(8-3-2-4-16-8)13-10(15)7(11)5-9(12)14/h6-8H,2-5,11H2,1H3,(H2,12,14)(H,13,15).
What are the key properties of 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide?
2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide has a molecular weight of 229.28 g/mol, XLogP of -1.13, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(oxolan-2-yl)ethyl]butanediamide is sourced from PubChem (CID 60848182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).