(1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide

C11H21NO2 — CID 175491800

IUPAC(1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
SMILESCC1CCC(C(C)C)[C@@](O)(C(N)=O)C1
InChIInChI=1S/C11H21NO2/c1-7(2)9-5-4-8(3)6-11(9,14)10(12)13/h7-9,14H,4-6H2,1-3H3,(H2,12,13)/t8?,9?,11-/m1/s1
InChIKeyUQPMNOQHGBTSKZ-NWGYLPEXSA-N
MW199.29 g/mol
LogP1.29
Rot. Bonds2

About (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide

(1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide (PubChem CID 175491800) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name(1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
PubChem CID175491800
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name(1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
SMILESCC1CCC(C(C)C)[C@@](O)(C(N)=O)C1
InChIInChI=1S/C11H21NO2/c1-7(2)9-5-4-8(3)6-11(9,14)10(12)13/h7-9,14H,4-6H2,1-3H3,(H2,12,13)/t8?,9?,11-/m1/s1
InChIKeyUQPMNOQHGBTSKZ-NWGYLPEXSA-N
XLogP1.29
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1R,2S,5R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexyl]ethanone
CID 142684025
N-ethyl-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 163406245
1-hydroxy-N-(2-hydroxyethyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 175491842
1-[(2S)-2-amino-2-cyclohexylethyl]-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 140775967
1-(butan-2-ylamino)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 54908142
1-(2-amino-2-oxoethyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxylic acid
CID 66599643
ethyl 2-(1-carbamoyl-5-methyl-2-propan-2-ylcyclohexyl)acetate
CID 68627782
tert-butyl (1S,2S,5R)-1-amino-5-methyl-2-propan-2-ylcyclohexane-1-carboxylate
CID 125426263
cis-(2S,5R)-1-[(3Z)-5-hydroxypenta-1,3-dien-3-yl]-5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 101266253
1-(hydroxymethyl)-5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 19844421
1-hydroxy-5-methyl-N-[2-(4-methylphenyl)ethyl]-2-propan-2-ylcyclohexane-1-carboxamide
CID 175491819
2-[1-(ethylamino)-5-methyl-2-propan-2-ylcyclohexyl]acetamide
CID 65233567

Frequently Asked Questions

What is the IUPAC name of (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
The IUPAC name of (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide (CID 175491800) is (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide is CC1CCC(C(C)C)[C@@](O)(C(N)=O)C1.
What is the InChIKey of (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
The InChIKey is UQPMNOQHGBTSKZ-NWGYLPEXSA-N. The full InChI is InChI=1S/C11H21NO2/c1-7(2)9-5-4-8(3)6-11(9,14)10(12)13/h7-9,14H,4-6H2,1-3H3,(H2,12,13)/t8?,9?,11-/m1/s1.
What are the key properties of (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide?
(1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide has a molecular weight of 199.29 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-hydroxy-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 175491800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).