3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide

C15H19N3O3 — CID 128986107

IUPAC3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide
SMILESCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)CCc1ccco1
InChIInChI=1S/C15H19N3O3/c1-18-8-7-16-15(18)14-12(6-10-21-14)17-13(19)5-4-11-3-2-9-20-11/h2-3,7-9,12,14H,4-6,10H2,1H3,(H,17,19)/t12-,14-/m0/s1
InChIKeyPSLGKWDLLYXCPW-JSGCOSHPSA-N
MW289.33 g/mol
LogP1.59
Rot. Bonds5

About 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide

3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide (PubChem CID 128986107) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide
PubChem CID128986107
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide
SMILESCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)CCc1ccco1
InChIInChI=1S/C15H19N3O3/c1-18-8-7-16-15(18)14-12(6-10-21-14)17-13(19)5-4-11-3-2-9-20-11/h2-3,7-9,12,14H,4-6,10H2,1H3,(H,17,19)/t12-,14-/m0/s1
InChIKeyPSLGKWDLLYXCPW-JSGCOSHPSA-N
XLogP1.59
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-fluorophenyl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide
CID 128969379
(2S,3S)-N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-(1-methylimidazol-2-yl)oxan-3-amine
CID 129476158
2-(3,5-dimethylpyrazol-1-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]acetamide
CID 128986083
(2S,5R)-5-methyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]oxolane-2-carboxamide
CID 129333968
3-(furan-2-yl)-1-(1-methylimidazol-2-yl)propan-1-one
CID 105101081
1-cyclopropyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]pyrrole-2-carboxamide
CID 128968417
(2R,3S)-2-(1-methylimidazol-2-yl)oxolane-3-carboxylic acid
CID 124709720
N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]oxane-2-carboxamide
CID 128970459
2-[3-(furan-2-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 64813064
cis-(1R,2S)-2-cyclohexyl-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]cyclopropane-1-carboxamide
CID 129330273
1-[(4-fluorophenyl)methyl]-3-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]urea
CID 128977421
N-[(1R,2R)-2-aminocyclohexyl]-3-(furan-2-yl)propanamide
CID 93452004

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide (CID 128986107) is 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide is Cn1ccnc1[C@H]1OCC[C@@H]1NC(=O)CCc1ccco1.
What is the InChIKey of 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide?
The InChIKey is PSLGKWDLLYXCPW-JSGCOSHPSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-18-8-7-16-15(18)14-12(6-10-21-14)17-13(19)5-4-11-3-2-9-20-11/h2-3,7-9,12,14H,4-6,10H2,1H3,(H,17,19)/t12-,14-/m0/s1.
What are the key properties of 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide?
3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide has a molecular weight of 289.33 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]propanamide is sourced from PubChem (CID 128986107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).