2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide

C15H30N2O2 — CID 112555896

IUPAC2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide
SMILESCCC1(CC)CC(NC(=O)C(N)C(C)(C)C)CCO1
InChIInChI=1S/C15H30N2O2/c1-6-15(7-2)10-11(8-9-19-15)17-13(18)12(16)14(3,4)5/h11-12H,6-10,16H2,1-5H3,(H,17,18)
InChIKeyCEGGWBAKKSNGNZ-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.21
Rot. Bonds4

About 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide

2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide (PubChem CID 112555896) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide
PubChem CID112555896
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide
SMILESCCC1(CC)CC(NC(=O)C(N)C(C)(C)C)CCO1
InChIInChI=1S/C15H30N2O2/c1-6-15(7-2)10-11(8-9-19-15)17-13(18)12(16)14(3,4)5/h11-12H,6-10,16H2,1-5H3,(H,17,18)
InChIKeyCEGGWBAKKSNGNZ-UHFFFAOYSA-N
XLogP2.21
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(2,2-dimethyloxan-4-yl)-3,3-dimethylbutanamide
CID 83033449
(2S)-2-amino-N-(2,2-diethyloxan-4-yl)-3-methylpentanamide
CID 83029138
2-amino-N-(2,2-diethyloxan-4-yl)butanediamide
CID 83028377
3-amino-N-(2,2-diethyloxan-4-yl)-2-methoxypropanamide
CID 114145179
3-amino-3-cyclopropyl-N-(2,2-diethyloxan-4-yl)propanamide
CID 83028921
(2R)-2-amino-N-(2,2-diethyloxan-4-yl)-4-methylsulfanylbutanamide
CID 104908950
2-amino-N-(2,2-diethyloxan-4-yl)-3,3,3-trifluoro-2-methylpropanamide
CID 83028310
2-(aminomethyl)-N-(2,2-diethyloxan-4-yl)-4-methylpentanamide
CID 83029071
N-(2,2-diethyloxan-4-yl)prop-2-enamide
CID 83032720
1-amino-N-(2,2-diethyloxan-4-yl)cyclobutane-1-carboxamide
CID 83028998
2-cyano-N-(2,2-diethyloxan-4-yl)-2-methylbutanamide
CID 83029367
1-(2,2-diethyloxan-4-yl)-3-propylurea
CID 115865557

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide (CID 112555896) is 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide is CCC1(CC)CC(NC(=O)C(N)C(C)(C)C)CCO1.
What is the InChIKey of 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide?
The InChIKey is CEGGWBAKKSNGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-6-15(7-2)10-11(8-9-19-15)17-13(18)12(16)14(3,4)5/h11-12H,6-10,16H2,1-5H3,(H,17,18).
What are the key properties of 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide?
2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide has a molecular weight of 270.42 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide is sourced from PubChem (CID 112555896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).