N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide

C14H18N2O2 — CID 75690987

IUPACN-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide
SMILESO=C(NCC1CCOC1)N1CCc2ccccc21
InChIInChI=1S/C14H18N2O2/c17-14(15-9-11-6-8-18-10-11)16-7-5-12-3-1-2-4-13(12)16/h1-4,11H,5-10H2,(H,15,17)
InChIKeyHXKGXLBELUURNW-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.80
Rot. Bonds2

About N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide

N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide (PubChem CID 75690987) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide
PubChem CID75690987
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide
SMILESO=C(NCC1CCOC1)N1CCc2ccccc21
InChIInChI=1S/C14H18N2O2/c17-14(15-9-11-6-8-18-10-11)16-7-5-12-3-1-2-4-13(12)16/h1-4,11H,5-10H2,(H,15,17)
InChIKeyHXKGXLBELUURNW-UHFFFAOYSA-N
XLogP1.80
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclohexylmethyl)-2,3-dihydroindole-1-carboxamide
CID 67190094
N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]-2,3-dihydroindole-1-carboxamide
CID 49110751
N-(cyclohexylmethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69223772
N-(oxiran-2-ylmethyl)-3,4-dihydro-2H-quinoline-1-carboxamide
CID 150484451
N-(2-cyclopentylethyl)-2,3-dihydroindole-1-carboxamide
CID 126767555
N-(oxolan-2-ylmethyl)-3,4-dihydro-2H-quinoline-1-carboxamide
CID 47191359
N-[[1-(3,4-difluorophenyl)pyrrolidin-3-yl]methyl]-2,3-dihydroindole-1-carboxamide
CID 60591263
1-[5-(oxolan-3-ylmethylamino)-2,3-dihydroindol-1-yl]ethanone
CID 43684646
(3R)-N-[[4-[2-(2,3-dihydroindol-1-yl)ethylcarbamoyl]cyclohexyl]methyl]oxolane-3-carboxamide
CID 51504785
N-[[(3S)-oxolan-3-yl]methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 94124241
N'-methyl-N-(oxolan-3-ylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboximidamide;hydroiodide
CID 110946459
N-(2-methoxyethyl)-2,3-dihydroindole-1-carboxamide
CID 47193672

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide (CID 75690987) is N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide is O=C(NCC1CCOC1)N1CCc2ccccc21.
What is the InChIKey of N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide?
The InChIKey is HXKGXLBELUURNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-14(15-9-11-6-8-18-10-11)16-7-5-12-3-1-2-4-13(12)16/h1-4,11H,5-10H2,(H,15,17).
What are the key properties of N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide?
N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide has a molecular weight of 246.31 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-ylmethyl)-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 75690987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).