N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide

C9H15NO3 — CID 131176764

IUPACN-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide
SMILESO=C(N[C@@H]1C[C@H]1CO)C1CCCO1
InChIInChI=1S/C9H15NO3/c11-5-6-4-7(6)10-9(12)8-2-1-3-13-8/h6-8,11H,1-5H2,(H,10,12)/t6-,7+,8?/m0/s1
InChIKeyUXHLCLHUQYWVKQ-KJFJCRTCSA-N
MW185.22 g/mol
LogP-0.34
Rot. Bonds3

About N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide

N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide (PubChem CID 131176764) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide
PubChem CID131176764
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC NameN-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide
SMILESO=C(N[C@@H]1C[C@H]1CO)C1CCCO1
InChIInChI=1S/C9H15NO3/c11-5-6-4-7(6)10-9(12)8-2-1-3-13-8/h6-8,11H,1-5H2,(H,10,12)/t6-,7+,8?/m0/s1
InChIKeyUXHLCLHUQYWVKQ-KJFJCRTCSA-N
XLogP-0.34
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[(1R,2R)-2-methylcyclopropyl]oxolane-2-carboxamide
CID 130652257
N-(2-aminocyclopropyl)oxane-2-carboxamide
CID 62214437
(2R)-N-[2-(aminomethyl)cyclopentyl]oxolane-2-carboxamide
CID 104856349
(2S)-N-(2-aminocycloheptyl)oxolane-2-carboxamide
CID 104856246
N-(2-methylcyclopropyl)oxane-2-carboxamide
CID 131084366
(2R)-N-[(1S,2S)-2-hydroxycyclohexyl]oxolane-2-carboxamide
CID 104956743
(2R)-N-cyclopropyloxolane-2-carboxamide
CID 40569533
(2S)-N-cyclopentyloxolane-2-carboxamide
CID 7368997
(2R)-N-cyclopentyloxolane-2-carboxamide
CID 7368998
N-(2-aminocyclopentyl)oxane-2-carboxamide
CID 63251301
3-(oxolane-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 66032104
(2S)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]oxolane-2-carboxamide
CID 107846708

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide?
The IUPAC name of N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide (CID 131176764) is N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide?
The canonical SMILES for N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide is O=C(N[C@@H]1C[C@H]1CO)C1CCCO1.
What is the InChIKey of N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide?
The InChIKey is UXHLCLHUQYWVKQ-KJFJCRTCSA-N. The full InChI is InChI=1S/C9H15NO3/c11-5-6-4-7(6)10-9(12)8-2-1-3-13-8/h6-8,11H,1-5H2,(H,10,12)/t6-,7+,8?/m0/s1.
What are the key properties of N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide?
N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide has a molecular weight of 185.22 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]oxolane-2-carboxamide is sourced from PubChem (CID 131176764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).