2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide

C15H22N2O2 — CID 83033070

IUPAC2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide
SMILESCC1(C)CC(NCC(=O)Nc2ccccc2)CCO1
InChIInChI=1S/C15H22N2O2/c1-15(2)10-13(8-9-19-15)16-11-14(18)17-12-6-4-3-5-7-12/h3-7,13,16H,8-11H2,1-2H3,(H,17,18)
InChIKeyKMKBEZLPTLSOMV-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.17
Rot. Bonds4

About 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide

2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide (PubChem CID 83033070) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide.

Molecular Properties

Compound Name2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide
PubChem CID83033070
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide
SMILESCC1(C)CC(NCC(=O)Nc2ccccc2)CCO1
InChIInChI=1S/C15H22N2O2/c1-15(2)10-13(8-9-19-15)16-11-14(18)17-12-6-4-3-5-7-12/h3-7,13,16H,8-11H2,1-2H3,(H,17,18)
InChIKeyKMKBEZLPTLSOMV-UHFFFAOYSA-N
XLogP2.17
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-ethylcyclohexyl)amino]-N-phenylacetamide
CID 60958245
N-butyl-2-[(2,2-dimethyloxan-4-yl)amino]acetamide
CID 83033491
2-[(2,2-dimethyloxan-4-yl)amino]-N-(2-methoxyethyl)acetamide
CID 83032655
3-[[(2,2-dimethyloxan-4-yl)amino]methyl]benzoic acid
CID 103261138
2-[2-(aminomethyl)phenyl]-N-(2,2-dimethyloxan-4-yl)acetamide
CID 83028620
1-(2,2-dimethyloxan-4-yl)-3-(4-fluorophenyl)urea
CID 3688648
2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide
CID 114546053
2-[(3,3-dimethylcyclohexyl)amino]-N-(3-fluorophenyl)acetamide
CID 81421882
2-[(2,2-dimethyloxan-4-yl)amino]-N-ethyl-N-methylacetamide
CID 83033158
N-(4-methylphenyl)-2-(oxolan-3-ylamino)acetamide
CID 80713616
2-[(2,2-dimethyloxan-4-yl)carbamoylamino]benzoic acid
CID 83034494
2-[(3-ethoxycyclobutyl)amino]-N-phenylacetamide
CID 103921112

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide?
The IUPAC name of 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide (CID 83033070) is 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide.
What is the SMILES notation for 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide?
The canonical SMILES for 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide is CC1(C)CC(NCC(=O)Nc2ccccc2)CCO1.
What is the InChIKey of 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide?
The InChIKey is KMKBEZLPTLSOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-15(2)10-13(8-9-19-15)16-11-14(18)17-12-6-4-3-5-7-12/h3-7,13,16H,8-11H2,1-2H3,(H,17,18).
What are the key properties of 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide?
2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide has a molecular weight of 262.35 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethyloxan-4-yl)amino]-N-phenylacetamide is sourced from PubChem (CID 83033070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).