3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide

C9H18N2O2 — CID 80717739

IUPAC3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide
SMILESCC(C)(CN)C(=O)NC1CCOC1
InChIInChI=1S/C9H18N2O2/c1-9(2,6-10)8(12)11-7-3-4-13-5-7/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyKUVIXVPPSNJEMK-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.12
Rot. Bonds3

About 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide

3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide (PubChem CID 80717739) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide
PubChem CID80717739
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide
SMILESCC(C)(CN)C(=O)NC1CCOC1
InChIInChI=1S/C9H18N2O2/c1-9(2,6-10)8(12)11-7-3-4-13-5-7/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyKUVIXVPPSNJEMK-UHFFFAOYSA-N
XLogP-0.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-(oxolan-3-yl)propanamide
CID 58469645
2-amino-2-ethyl-N-(oxolan-3-yl)butanamide
CID 80712528
2-(aminomethyl)-4,4-dimethyl-N-(oxolan-3-yl)pentanamide
CID 107472463
(2R)-2-amino-3,3-dimethyl-N-(oxolan-3-yl)butanamide
CID 103930246
4-amino-4-methyl-N-(oxolan-3-yl)pentanamide
CID 80713467
1-tert-butyl-3-(oxolan-3-yl)urea
CID 115755738
3,3-difluoro-N-(oxolan-3-yl)butanamide
CID 130702956
2-amino-2-methyl-N-(oxan-4-yl)butanamide
CID 79797444
3-amino-2,2-dimethyl-N-(4-propylcyclohexyl)propanamide;hydrochloride
CID 119750378
3-amino-2,2-dimethyl-N-(1-propylpiperidin-4-yl)propanamide;dihydrochloride
CID 119834906
2-amino-2-methyl-N-(oxan-3-yl)pentanamide
CID 63361438
1-(3-amino-3-hydroxyimino-2,2-dimethylpropyl)-3-(oxolan-3-yl)urea
CID 104873824

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide (CID 80717739) is 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide is CC(C)(CN)C(=O)NC1CCOC1.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide?
The InChIKey is KUVIXVPPSNJEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-9(2,6-10)8(12)11-7-3-4-13-5-7/h7H,3-6,10H2,1-2H3,(H,11,12).
What are the key properties of 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide?
3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide has a molecular weight of 186.25 g/mol, XLogP of -0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide is sourced from PubChem (CID 80717739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).