(4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide

C14H25NO2 — CID 929884

IUPAC(4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide
SMILESCC1(C)C[C@H](C(=O)NC2CCCCC2)CCO1
InChIInChI=1S/C14H25NO2/c1-14(2)10-11(8-9-17-14)13(16)15-12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,15,16)/t11-/m1/s1
InChIKeyATIGWZIUOICJKZ-LLVKDONJSA-N
MW239.36 g/mol
LogP2.64
Rot. Bonds2

About (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide

(4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide (PubChem CID 929884) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide.

Molecular Properties

Compound Name(4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide
PubChem CID929884
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide
SMILESCC1(C)C[C@H](C(=O)NC2CCCCC2)CCO1
InChIInChI=1S/C14H25NO2/c1-14(2)10-11(8-9-17-14)13(16)15-12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,15,16)/t11-/m1/s1
InChIKeyATIGWZIUOICJKZ-LLVKDONJSA-N
XLogP2.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-tert-butyl-4-propan-2-ylcyclohexyl)-2,2-dimethyloxane-4-carboxamide
CID 122679848
1-cyclohexyl-N-(2,2-dimethyloxan-4-yl)azetidine-3-carboxamide
CID 122152344
3-[(2,2-dimethyloxan-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 83028917
N-cyclohexyl-2,2,6,6-tetramethylpiperidine-4-carboxamide
CID 90092330
N-cyclodecylcyclododecanecarboxamide
CID 135182352
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-cycloheptylcycloheptanecarboxamide
CID 129091005
cis-(1S,2R)-2-[(2,2-dimethyloxan-4-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 114092749
(2R,5S)-5-[(2,2-dimethyloxan-4-yl)carbamoyl]oxolane-2-carboxylic acid
CID 102945599
N-cyclopentyl-2,2-dimethylcyclopropane-1-carboxamide
CID 103837196
1-(2,2-dimethyloxan-4-yl)propan-1-one
CID 3342537
(4S,5S)-4-N,5-N-dicyclohexyl-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxamide
CID 981369

Frequently Asked Questions

What is the IUPAC name of (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide?
The IUPAC name of (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide (CID 929884) is (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide.
What is the SMILES notation for (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide?
The canonical SMILES for (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide is CC1(C)C[C@H](C(=O)NC2CCCCC2)CCO1.
What is the InChIKey of (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide?
The InChIKey is ATIGWZIUOICJKZ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H25NO2/c1-14(2)10-11(8-9-17-14)13(16)15-12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,15,16)/t11-/m1/s1.
What are the key properties of (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide?
(4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N-cyclohexyl-2,2-dimethyloxane-4-carboxamide is sourced from PubChem (CID 929884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).