(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide

C15H17N3O2 — CID 94211931

IUPAC(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide
SMILESO=C(Nc1nccn1Cc1ccccc1)[C@H]1CCCO1
InChIInChI=1S/C15H17N3O2/c19-14(13-7-4-10-20-13)17-15-16-8-9-18(15)11-12-5-2-1-3-6-12/h1-3,5-6,8-9,13H,4,7,10-11H2,(H,16,17,19)/t13-/m1/s1
InChIKeyBKGLHAHKGMGHKR-CYBMUJFWSA-N
MW271.32 g/mol
LogP2.05
Rot. Bonds4

About (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide

(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide (PubChem CID 94211931) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide
PubChem CID94211931
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide
SMILESO=C(Nc1nccn1Cc1ccccc1)[C@H]1CCCO1
InChIInChI=1S/C15H17N3O2/c19-14(13-7-4-10-20-13)17-15-16-8-9-18(15)11-12-5-2-1-3-6-12/h1-3,5-6,8-9,13H,4,7,10-11H2,(H,16,17,19)/t13-/m1/s1
InChIKeyBKGLHAHKGMGHKR-CYBMUJFWSA-N
XLogP2.05
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-benzylimidazol-2-yl)ethyl]oxolane-2-carboxamide
CID 42951665
N-(1-benzylimidazol-2-yl)piperidine-3-carboxamide
CID 119297675
(4R)-N-(1-benzylimidazol-2-yl)-1-methyl-2-oxopiperidine-4-carboxamide
CID 97313572
(2S)-N-(1-benzylimidazol-2-yl)-2-[[(2R)-oxan-2-yl]methoxy]propanamide
CID 94820641
N-phenyloxolane-2-carboxamide
CID 3453643
(2R)-N-[[1-(3-phenylpropyl)imidazol-2-yl]methyl]oxolane-2-carboxamide
CID 96570710
(2S)-N-(1-benzyl-3,5-dimethylpyrazol-4-yl)oxolane-2-carboxamide
CID 35278282
(2S)-N-[4-(4-benzylpiperazin-1-yl)phenyl]oxolane-2-carboxamide
CID 35893855
1-amino-N-(1-benzylimidazol-2-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119297670
N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)oxolane-2-carboxamide
CID 53204396
N-[4-[benzyl(methyl)amino]phenyl]oxolane-2-carboxamide
CID 112982284
N-(4-anilinophenyl)oxolane-2-carboxamide
CID 4690010

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide?
The IUPAC name of (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide (CID 94211931) is (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide is O=C(Nc1nccn1Cc1ccccc1)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide?
The InChIKey is BKGLHAHKGMGHKR-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-14(13-7-4-10-20-13)17-15-16-8-9-18(15)11-12-5-2-1-3-6-12/h1-3,5-6,8-9,13H,4,7,10-11H2,(H,16,17,19)/t13-/m1/s1.
What are the key properties of (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide?
(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide is sourced from PubChem (CID 94211931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).