N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide

C24H27NO3 — CID 126437748

IUPACN-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide
SMILESCN(CCC[C@H]1CCCO1)C(=O)c1ccc(-c2ccc3c(c2)CCC3=O)cc1
InChIInChI=1S/C24H27NO3/c1-25(14-2-4-21-5-3-15-28-21)24(27)18-8-6-17(7-9-18)19-10-12-22-20(16-19)11-13-23(22)26/h6-10,12,16,21H,2-5,11,13-15H2,1H3/t21-/m0/s1
InChIKeyLOSAAZZCBYRQQO-NRFANRHFSA-N
MW377.48 g/mol
LogP4.51
Rot. Bonds6

About N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide

N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide (PubChem CID 126437748) has the molecular formula C24H27NO3 and a molecular weight of 377.48 g/mol. Its IUPAC name is N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide
PubChem CID126437748
Molecular FormulaC24H27NO3
Molecular Weight377.48 g/mol
Exact Mass377.20
IUPAC NameN-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide
SMILESCN(CCC[C@H]1CCCO1)C(=O)c1ccc(-c2ccc3c(c2)CCC3=O)cc1
InChIInChI=1S/C24H27NO3/c1-25(14-2-4-21-5-3-15-28-21)24(27)18-8-6-17(7-9-18)19-10-12-22-20(16-19)11-13-23(22)26/h6-10,12,16,21H,2-5,11,13-15H2,1H3/t21-/m0/s1
InChIKeyLOSAAZZCBYRQQO-NRFANRHFSA-N
XLogP4.51
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.48
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide with MolForge

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Related Compounds

N-methyl-4-(3-methyl-4-pyridinyl)-N-[3-(oxolan-2-yl)propyl]benzamide
CID 119067493
3-(3-fluoro-4-pyridinyl)-N-methyl-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide
CID 125159693
2-methoxy-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]pyrimidine-5-carboxamide
CID 126439627
3-[4-(3-fluorophenyl)phenyl]-1-methyl-1-[3-(oxolan-2-yl)propyl]urea
CID 118761000
3-(6-cyano-2-pyridinyl)-N-methyl-N-[3-[(2R)-oxolan-2-yl]propyl]benzamide
CID 126444243
2-[3-[methyl-[3-(oxolan-2-yl)propyl]carbamoyl]phenyl]pyridine-3-carboxamide
CID 118787231
5-(difluoromethyl)-N-methyl-N-[3-(oxolan-2-yl)propyl]-1H-pyrazole-3-carboxamide
CID 121495548
3,5-difluoro-N-methyl-N-[3-(oxolan-2-yl)propyl]pyridine-2-carboxamide
CID 91776280
N-(3-cyclopentylpropyl)-N-methyl-4-pyridin-4-ylbenzamide
CID 119060730
N-methyl-N-[3-[(2S)-oxolan-2-yl]propyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide
CID 125168534
4-(4-fluorophenyl)-N-methyl-N-[3-(oxolan-2-yl)propyl]butanamide
CID 135108533
N-methyl-N-[2-[(2S)-oxan-2-yl]ethyl]-4-(piperidin-1-ylmethyl)benzamide
CID 97201362

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide?
The IUPAC name of N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide (CID 126437748) is N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide.
What is the SMILES notation for N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide?
The canonical SMILES for N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide is CN(CCC[C@H]1CCCO1)C(=O)c1ccc(-c2ccc3c(c2)CCC3=O)cc1.
What is the InChIKey of N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide?
The InChIKey is LOSAAZZCBYRQQO-NRFANRHFSA-N. The full InChI is InChI=1S/C24H27NO3/c1-25(14-2-4-21-5-3-15-28-21)24(27)18-8-6-17(7-9-18)19-10-12-22-20(16-19)11-13-23(22)26/h6-10,12,16,21H,2-5,11,13-15H2,1H3/t21-/m0/s1.
What are the key properties of N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide?
N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide has a molecular weight of 377.48 g/mol, XLogP of 4.51, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-oxo-2,3-dihydroinden-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide is sourced from PubChem (CID 126437748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).