1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide

C14H23N3O3S — CID 127958223

IUPAC1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide
SMILESCn1ccnc1[C@H]1OCC[C@@H]1NS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H23N3O3S/c1-17-8-7-15-14(17)13-12(6-9-20-13)16-21(18,19)10-11-4-2-3-5-11/h7-8,11-13,16H,2-6,9-10H2,1H3/t12-,13-/m0/s1
InChIKeyKCRCOMJBOJKVPF-STQMWFEESA-N
MW313.42 g/mol
LogP1.36
Rot. Bonds5

About 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide

1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide (PubChem CID 127958223) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide
PubChem CID127958223
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC Name1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide
SMILESCn1ccnc1[C@H]1OCC[C@@H]1NS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H23N3O3S/c1-17-8-7-15-14(17)13-12(6-9-20-13)16-21(18,19)10-11-4-2-3-5-11/h7-8,11-13,16H,2-6,9-10H2,1H3/t12-,13-/m0/s1
InChIKeyKCRCOMJBOJKVPF-STQMWFEESA-N
XLogP1.36
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrazole-3-sulfonamide
CID 154738122
N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]oxane-2-carboxamide
CID 128970459
2-cyano-3-methyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]benzenesulfonamide
CID 128975417
(2S,3S)-N-(1,3-diphenylpropan-2-yl)-2-(1-methylimidazol-2-yl)oxolan-3-amine
CID 154794407
cis-(1R,2S)-2-cyclohexyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]cyclopropane-1-carboxamide
CID 129330273
1-[(2R)-4-(dimethylamino)butan-2-yl]-3-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]urea
CID 129475001
(2R,3S)-2-(1-methylimidazol-2-yl)oxolane-3-carboxylic acid
CID 124709720
1-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]-3-(thiolan-2-ylmethyl)urea
CID 128988869
N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]cycloheptene-1-carboxamide
CID 128989683
(2S,3S)-2-(1-methylimidazol-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]oxan-3-amine
CID 128992705
(2S,5R)-5-methyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]oxolane-2-carboxamide
CID 129333968
1-cyclopropyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrrole-2-carboxamide
CID 128968417

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide?
The IUPAC name of 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide (CID 127958223) is 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide.
What is the SMILES notation for 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide?
The canonical SMILES for 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide is Cn1ccnc1[C@H]1OCC[C@@H]1NS(=O)(=O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide?
The InChIKey is KCRCOMJBOJKVPF-STQMWFEESA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-17-8-7-15-14(17)13-12(6-9-20-13)16-21(18,19)10-11-4-2-3-5-11/h7-8,11-13,16H,2-6,9-10H2,1H3/t12-,13-/m0/s1.
What are the key properties of 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide?
1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide has a molecular weight of 313.42 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methanesulfonamide is sourced from PubChem (CID 127958223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).