3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide

C11H22N2O2 — CID 62668913

IUPAC3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide
SMILESCCN(CC1CCOC1)C(=O)C(C)CN
InChIInChI=1S/C11H22N2O2/c1-3-13(11(14)9(2)6-12)7-10-4-5-15-8-10/h9-10H,3-8,12H2,1-2H3
InChIKeyYPOYCNFDBGTPOJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.47
Rot. Bonds5

About 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide

3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide (PubChem CID 62668913) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide
PubChem CID62668913
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide
SMILESCCN(CC1CCOC1)C(=O)C(C)CN
InChIInChI=1S/C11H22N2O2/c1-3-13(11(14)9(2)6-12)7-10-4-5-15-8-10/h9-10H,3-8,12H2,1-2H3
InChIKeyYPOYCNFDBGTPOJ-UHFFFAOYSA-N
XLogP0.47
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)propanamide
CID 61148831
2-amino-N-ethyl-N-(oxolan-3-ylmethyl)hexanamide
CID 54874277
N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)butanamide
CID 51082548
N-ethyl-3-methyl-N-[[(3S)-oxolan-3-yl]methyl]butanamide
CID 94186751
N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide
CID 43433587
2-amino-N-ethyl-N-(oxolan-3-ylmethyl)cyclopropane-1-carboxamide
CID 114995328
5-[ethyl(oxolan-3-ylmethyl)amino]-3-methyl-5-oxopentanoic acid
CID 62964406
N-ethyl-N-(oxolan-3-ylmethyl)-2-(4-phenylphenoxy)propanamide
CID 55744625
N-ethyl-N-(oxolan-3-ylmethyl)-3-(propan-2-ylamino)propanamide
CID 54874267
2-amino-N-ethyl-3-(4-hydroxyphenyl)-N-(oxolan-3-ylmethyl)propanamide
CID 76894991
(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)-4-phenylbutanamide
CID 104984084
2-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]sulfanylacetic acid
CID 104569649

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide?
The IUPAC name of 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide (CID 62668913) is 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide.
What is the SMILES notation for 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide?
The canonical SMILES for 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide is CCN(CC1CCOC1)C(=O)C(C)CN.
What is the InChIKey of 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide?
The InChIKey is YPOYCNFDBGTPOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-13(11(14)9(2)6-12)7-10-4-5-15-8-10/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide?
3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide has a molecular weight of 214.31 g/mol, XLogP of 0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide is sourced from PubChem (CID 62668913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).