3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide

C11H22N2O3 — CID 61276283

IUPAC3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide
SMILESNCCC(=O)NCCCOCC1CCCO1
InChIInChI=1S/C11H22N2O3/c12-5-4-11(14)13-6-2-7-15-9-10-3-1-8-16-10/h10H,1-9,12H2,(H,13,14)
InChIKeyACIWCIGWRIJEOL-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.04
Rot. Bonds8

About 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide

3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide (PubChem CID 61276283) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide
PubChem CID61276283
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide
SMILESNCCC(=O)NCCCOCC1CCCO1
InChIInChI=1S/C11H22N2O3/c12-5-4-11(14)13-6-2-7-15-9-10-3-1-8-16-10/h10H,1-9,12H2,(H,13,14)
InChIKeyACIWCIGWRIJEOL-UHFFFAOYSA-N
XLogP0.04
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-amino-N-[3-(oxolan-2-ylmethoxy)propyl]heptanamide
CID 61274559
2-bromo-N-[3-(oxolan-2-ylmethoxy)propyl]acetamide
CID 63680867
3-(cyclopropylamino)-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide
CID 61275516
3-(2-aminophenyl)-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide;hydrochloride
CID 120608330
2-hydroxyethyl N-[3-(oxolan-2-ylmethoxy)propyl]carbamate
CID 79345576
3-[[N'-methyl-N-[3-(oxolan-2-ylmethoxy)propyl]carbamimidoyl]amino]-N-propylpropanamide
CID 111408865
2-(2-methylphenyl)-N-[3-[[(2R)-oxolan-2-yl]methoxy]propyl]acetamide
CID 94421971
2-(3-aminophenyl)-N-[3-(oxolan-2-ylmethoxy)propyl]acetamide
CID 65350539
2-bromo-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide
CID 107904862
(2R)-2-amino-3-methyl-N-[3-(oxolan-2-ylmethoxy)propyl]butanamide
CID 79013082
N-[3-[[(2S)-oxolan-2-yl]methoxy]propyl]benzamide
CID 94598600
2-amino-2-methyl-N-[3-(oxolan-2-ylmethoxy)propyl]butanamide
CID 79805275

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide?
The IUPAC name of 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide (CID 61276283) is 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide.
What is the SMILES notation for 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide?
The canonical SMILES for 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide is NCCC(=O)NCCCOCC1CCCO1.
What is the InChIKey of 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide?
The InChIKey is ACIWCIGWRIJEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c12-5-4-11(14)13-6-2-7-15-9-10-3-1-8-16-10/h10H,1-9,12H2,(H,13,14).
What are the key properties of 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide?
3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide has a molecular weight of 230.31 g/mol, XLogP of 0.04, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide is sourced from PubChem (CID 61276283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).