2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide

C9H17NO2 — CID 40531863

IUPAC2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide
SMILESCC(C)C(=O)NC[C@H]1CCCO1
InChIInChI=1S/C9H17NO2/c1-7(2)9(11)10-6-8-4-3-5-12-8/h7-8H,3-6H2,1-2H3,(H,10,11)/t8-/m1/s1
InChIKeyGLVNZQDYDQXKQX-MRVPVSSYSA-N
MW171.24 g/mol
LogP0.94
Rot. Bonds3

About 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide

2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide (PubChem CID 40531863) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide
PubChem CID40531863
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide
SMILESCC(C)C(=O)NC[C@H]1CCCO1
InChIInChI=1S/C9H17NO2/c1-7(2)9(11)10-6-8-4-3-5-12-8/h7-8H,3-6H2,1-2H3,(H,10,11)/t8-/m1/s1
InChIKeyGLVNZQDYDQXKQX-MRVPVSSYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(oxolan-2-ylmethyl)propanamide
CID 61145996
2-amino-N-(oxolan-2-ylmethyl)propanamide
CID 24697469
2-methyl-N-(oxolan-2-ylmethylcarbamothioyl)propanamide
CID 19176066
(2R)-2-methylsulfonyl-N-[[(2S)-oxolan-2-yl]methyl]propanamide
CID 94067063
(2S)-N-[[(2S)-oxolan-2-yl]methyl]-2-(propanoylamino)propanamide
CID 94796972
(2R)-2-bromo-N-[[(2R)-oxolan-2-yl]methyl]butanamide
CID 94882952
(2S)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)pentanamide
CID 61174562
3-methyl-N-(oxolan-2-ylmethyl)butanamide
CID 3509797
2-methyl-N-(oxiran-2-ylmethyl)propanamide
CID 102548474
(2S)-2-(2,5-dioxopyrrolidin-1-yl)-N-(oxolan-2-ylmethyl)propanamide
CID 17034856
[(2S)-oxolan-2-yl]methylcarbamic acid
CID 69040354
4-amino-2-methyl-N-(oxan-2-ylmethyl)butanamide
CID 80543915

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
The IUPAC name of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide (CID 40531863) is 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide.
What is the SMILES notation for 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
The canonical SMILES for 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide is CC(C)C(=O)NC[C@H]1CCCO1.
What is the InChIKey of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
The InChIKey is GLVNZQDYDQXKQX-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-7(2)9(11)10-6-8-4-3-5-12-8/h7-8H,3-6H2,1-2H3,(H,10,11)/t8-/m1/s1.
What are the key properties of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide has a molecular weight of 171.24 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide is sourced from PubChem (CID 40531863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).