(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide

C11H19NO3 — CID 104956743

IUPAC(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide
SMILESO=C(N[C@H]1CCCC[C@@H]1O)[C@H]1CCCO1
InChIInChI=1S/C11H19NO3/c13-9-5-2-1-4-8(9)12-11(14)10-6-3-7-15-10/h8-10,13H,1-7H2,(H,12,14)/t8-,9-,10+/m0/s1
InChIKeyBVJBGEUYWHRLMZ-LPEHRKFASA-N
MW213.28 g/mol
LogP0.59
Rot. Bonds2

About (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide

(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide (PubChem CID 104956743) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide
PubChem CID104956743
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide
SMILESO=C(N[C@H]1CCCC[C@@H]1O)[C@H]1CCCO1
InChIInChI=1S/C11H19NO3/c13-9-5-2-1-4-8(9)12-11(14)10-6-3-7-15-10/h8-10,13H,1-7H2,(H,12,14)/t8-,9-,10+/m0/s1
InChIKeyBVJBGEUYWHRLMZ-LPEHRKFASA-N
XLogP0.59
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(2-aminocycloheptyl)oxolane-2-carboxamide
CID 104856246
(2S)-N-cyclopentyloxolane-2-carboxamide
CID 7368997
(2R)-N-cyclopentyloxolane-2-carboxamide
CID 7368998
(2S)-N-[(1R,2R)-2-methylcyclopropyl]oxolane-2-carboxamide
CID 130652257
N-(2-aminocyclopentyl)oxane-2-carboxamide
CID 63251301
N-(2-methylcyclopropyl)oxane-2-carboxamide
CID 131084366
N-(2-aminocyclopropyl)oxane-2-carboxamide
CID 62214437
(2R)-N-cyclopropyloxolane-2-carboxamide
CID 40569533
5-[(2-hydroxycyclohexyl)carbamoyl]oxolane-2-carboxylic acid
CID 102688444
(2R)-N-[2-(aminomethyl)cyclopentyl]oxolane-2-carboxamide
CID 104856349
N-[(1R,2R)-2-hydroxycyclohexyl]-5-methyloxolane-2-carboxamide
CID 104927544
N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide
CID 131176764

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide (CID 104956743) is (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide is O=C(N[C@H]1CCCC[C@@H]1O)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide?
The InChIKey is BVJBGEUYWHRLMZ-LPEHRKFASA-N. The full InChI is InChI=1S/C11H19NO3/c13-9-5-2-1-4-8(9)12-11(14)10-6-3-7-15-10/h8-10,13H,1-7H2,(H,12,14)/t8-,9-,10+/m0/s1.
What are the key properties of (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide?
(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide has a molecular weight of 213.28 g/mol, XLogP of 0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide is sourced from PubChem (CID 104956743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).