N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide

C10H20N2O3 — CID 104761397

IUPACN-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide
SMILESCNC(C)C(=O)NCC1(OC)CCOC1
InChIInChI=1S/C10H20N2O3/c1-8(11-2)9(13)12-6-10(14-3)4-5-15-7-10/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyWMVVGKVAYPWAHN-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.48
Rot. Bonds5

About N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide

N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide (PubChem CID 104761397) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide
PubChem CID104761397
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide
SMILESCNC(C)C(=O)NCC1(OC)CCOC1
InChIInChI=1S/C10H20N2O3/c1-8(11-2)9(13)12-6-10(14-3)4-5-15-7-10/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyWMVVGKVAYPWAHN-UHFFFAOYSA-N
XLogP-0.48
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[(3-methoxyoxolan-3-yl)methyl]-4-methylpentanamide
CID 113450272
propan-2-yl N-[(3-methoxyoxolan-3-yl)methyl]carbamate
CID 116657841
2-amino-N-[(3-methoxyoxolan-3-yl)methyl]butanediamide
CID 113450284
(3-methoxyoxolan-3-yl)methylurea
CID 104704481
2-chloro-N-[(3-methoxyoxolan-3-yl)methylcarbamoyl]propanamide
CID 104764442
2-[(3-methoxyoxolan-3-yl)methylcarbamoyl]-3,3-dimethylbutanoic acid
CID 116537472
N-[(3-methoxyoxolan-3-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 104761435
2-(N'-hydroxycarbamimidoyl)-N-[(3-methoxyoxolan-3-yl)methyl]-3-methylbutanamide
CID 104764646
2-[(3-methoxyoxolan-3-yl)methylamino]propanamide
CID 104704803
2-acetamido-N-[(3-methoxyoxolan-3-yl)methyl]-3-sulfanylpropanamide
CID 107769857
2-amino-N-[(3-methoxyoxolan-3-yl)methyl]acetamide
CID 104761415
N-[(3-methoxyoxolan-3-yl)methyl]-2,2-dimethylpropanamide
CID 104709004

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide?
The IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide (CID 104761397) is N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide.
What is the SMILES notation for N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide?
The canonical SMILES for N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide is CNC(C)C(=O)NCC1(OC)CCOC1.
What is the InChIKey of N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide?
The InChIKey is WMVVGKVAYPWAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-8(11-2)9(13)12-6-10(14-3)4-5-15-7-10/h8,11H,4-7H2,1-3H3,(H,12,13).
What are the key properties of N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide?
N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide has a molecular weight of 216.28 g/mol, XLogP of -0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyoxolan-3-yl)methyl]-2-(methylamino)propanamide is sourced from PubChem (CID 104761397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).