2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide

C10H20N2O3 — CID 81089453

IUPAC2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide
SMILESCOCC(N)C(=O)NCCC1CCCO1
InChIInChI=1S/C10H20N2O3/c1-14-7-9(11)10(13)12-5-4-8-3-2-6-15-8/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyNCVWNZLBXMLXLE-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.35
Rot. Bonds6

About 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide

2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide (PubChem CID 81089453) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide
PubChem CID81089453
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide
SMILESCOCC(N)C(=O)NCCC1CCCO1
InChIInChI=1S/C10H20N2O3/c1-14-7-9(11)10(13)12-5-4-8-3-2-6-15-8/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyNCVWNZLBXMLXLE-UHFFFAOYSA-N
XLogP-0.35
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 107569103
(3S)-3-amino-4-oxo-4-[2-(oxolan-2-yl)ethylamino]butanoic acid
CID 67894474
(2R)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 103794477
methyl N-[2-(oxolan-2-yl)ethyl]carbamate
CID 110731266
2-amino-4-methoxy-N-(oxolan-2-ylmethyl)butanamide
CID 62472979
2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 110731236
2-amino-5-methoxy-N-(oxolan-2-ylmethyl)pentanamide
CID 81081044
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 104984102
2-bromo-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 62856863
2-methoxy-3-[2-(oxolan-2-yl)ethylcarbamoylamino]propanoic acid
CID 106110007
4-methoxy-2-[2-(oxolan-2-yl)ethylcarbamoylamino]butanoic acid
CID 62474156
1-methoxy-3-[2-(oxolan-2-yl)ethylamino]propan-2-ol
CID 63928603

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide?
The IUPAC name of 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide (CID 81089453) is 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide is COCC(N)C(=O)NCCC1CCCO1.
What is the InChIKey of 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide?
The InChIKey is NCVWNZLBXMLXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-14-7-9(11)10(13)12-5-4-8-3-2-6-15-8/h8-9H,2-7,11H2,1H3,(H,12,13).
What are the key properties of 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide?
2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide has a molecular weight of 216.28 g/mol, XLogP of -0.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide is sourced from PubChem (CID 81089453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).