N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide

C16H29NO3 — CID 91798406

IUPACN-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide
SMILESCC1(C)COC(CCCC(=O)NC2CCCCC2)OC1
InChIInChI=1S/C16H29NO3/c1-16(2)11-19-15(20-12-16)10-6-9-14(18)17-13-7-4-3-5-8-13/h13,15H,3-12H2,1-2H3,(H,17,18)
InChIKeyPLWPLJICAIACTM-UHFFFAOYSA-N
MW283.41 g/mol
LogP3.00
Rot. Bonds5

About N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide

N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide (PubChem CID 91798406) has the molecular formula C16H29NO3 and a molecular weight of 283.41 g/mol. Its IUPAC name is N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide
PubChem CID91798406
Molecular FormulaC16H29NO3
Molecular Weight283.41 g/mol
Exact Mass283.21
IUPAC NameN-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide
SMILESCC1(C)COC(CCCC(=O)NC2CCCCC2)OC1
InChIInChI=1S/C16H29NO3/c1-16(2)11-19-15(20-12-16)10-6-9-14(18)17-13-7-4-3-5-8-13/h13,15H,3-12H2,1-2H3,(H,17,18)
InChIKeyPLWPLJICAIACTM-UHFFFAOYSA-N
XLogP3.00
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclohexyltetradecanamide
CID 10244853
N-cycloheptylnonanamide
CID 5045141
5-chloro-N-cyclooctylpentanamide
CID 28733608
N-cyclohexyl-5-hydroxypentanamide
CID 11367641
N-cyclooctylbutanamide
CID 4614062
(E)-N-cyclohexyloctadec-9-enamide
CID 10948482
methyl 6-(cyclopentylamino)-6-oxohexanoate
CID 162372122
N-cycloheptyl-N'-cyclopentylpropanediamide
CID 108942189
3-chloro-N-cycloheptylpropanamide
CID 5152151
4-(cycloheptylamino)-4-oxobutanoic acid
CID 2932888
N-cyclobutylicosanamide
CID 10384249
N-cyclobutylhexadecanamide
CID 67041463

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide?
The IUPAC name of N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide (CID 91798406) is N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide.
What is the SMILES notation for N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide?
The canonical SMILES for N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide is CC1(C)COC(CCCC(=O)NC2CCCCC2)OC1.
What is the InChIKey of N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide?
The InChIKey is PLWPLJICAIACTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO3/c1-16(2)11-19-15(20-12-16)10-6-9-14(18)17-13-7-4-3-5-8-13/h13,15H,3-12H2,1-2H3,(H,17,18).
What are the key properties of N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide?
N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide has a molecular weight of 283.41 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(5,5-dimethyl-1,3-dioxan-2-yl)butanamide is sourced from PubChem (CID 91798406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).