N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide

C15H18N2O2 — CID 43581991

IUPACN-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide
SMILESCC(NC(=O)c1cccc2[nH]ccc12)C1CCCO1
InChIInChI=1S/C15H18N2O2/c1-10(14-6-3-9-19-14)17-15(18)12-4-2-5-13-11(12)7-8-16-13/h2,4-5,7-8,10,14,16H,3,6,9H2,1H3,(H,17,18)
InChIKeyFLQQALABDAVQQB-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.47
Rot. Bonds3

About N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide

N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide (PubChem CID 43581991) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide
PubChem CID43581991
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide
SMILESCC(NC(=O)c1cccc2[nH]ccc12)C1CCCO1
InChIInChI=1S/C15H18N2O2/c1-10(14-6-3-9-19-14)17-15(18)12-4-2-5-13-11(12)7-8-16-13/h2,4-5,7-8,10,14,16H,3,6,9H2,1H3,(H,17,18)
InChIKeyFLQQALABDAVQQB-UHFFFAOYSA-N
XLogP2.47
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-difluoro-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 62648709
2-anilino-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 42955770
(2S)-2-(1H-indole-4-carbonylamino)propanoic acid
CID 93286189
N-(1-cyclopropylbutan-2-yl)-1H-indole-4-carboxamide
CID 63995977
N-(4-hydroxybutan-2-yl)-1H-indole-4-carboxamide
CID 81043314
5-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-2,5-dicarboxamide
CID 98786018
4-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 27232652
N-cyclopentyl-1H-indole-4-carboxamide
CID 43582325
3-hydrazinyl-2-nitro-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 115549566
3-(1H-indol-3-yl)-N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]propanamide
CID 35220767
3-[1-(oxolan-2-yl)ethylcarbamoyl]benzenesulfonyl chloride
CID 43533927
2-ethoxy-N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]pyridine-3-carboxamide
CID 35250402

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide?
The IUPAC name of N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide (CID 43581991) is N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide.
What is the SMILES notation for N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide?
The canonical SMILES for N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide is CC(NC(=O)c1cccc2[nH]ccc12)C1CCCO1.
What is the InChIKey of N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide?
The InChIKey is FLQQALABDAVQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(14-6-3-9-19-14)17-15(18)12-4-2-5-13-11(12)7-8-16-13/h2,4-5,7-8,10,14,16H,3,6,9H2,1H3,(H,17,18).
What are the key properties of N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide?
N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxolan-2-yl)ethyl]-1H-indole-4-carboxamide is sourced from PubChem (CID 43581991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).