N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide

C14H16N2O2 — CID 63717299

IUPACN-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C14H16N2O2/c17-14(16-9-12-2-1-7-18-12)11-3-4-13-10(8-11)5-6-15-13/h3-6,8,12,15H,1-2,7,9H2,(H,16,17)
InChIKeyHCHUWUMFCIXLAW-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.08
Rot. Bonds3

About N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide

N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide (PubChem CID 63717299) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide
PubChem CID63717299
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C14H16N2O2/c17-14(16-9-12-2-1-7-18-12)11-3-4-13-10(8-11)5-6-15-13/h3-6,8,12,15H,1-2,7,9H2,(H,16,17)
InChIKeyHCHUWUMFCIXLAW-UHFFFAOYSA-N
XLogP2.08
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[(2R)-oxolan-2-yl]methyl]-4-(1H-pyrrolo[2,3-b]pyridin-5-yl)benzamide
CID 126433758
4-fluoro-N-(oxolan-2-ylmethyl)benzamide
CID 531952
N-(piperidin-3-ylmethyl)-1H-indole-5-carboxamide
CID 55230606
4-amino-3-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 16789376
4-iodo-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 875708
4-amino-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 723405
3-nitro-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 966750
N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
CID 2964205
N-(cyclobutylmethyl)-1H-indole-6-carboxamide
CID 47190926
N-(oxolan-2-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-6-carboxamide
CID 110489055
N-(oxolan-2-ylmethyl)-3-(1H-pyrazol-4-yl)benzamide
CID 110486700
N-[[(2R)-oxolan-2-yl]methyl]-3H-benzo[e]indole-2-carboxamide
CID 39977666

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide (CID 63717299) is N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide is O=C(NCC1CCCO1)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide?
The InChIKey is HCHUWUMFCIXLAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-14(16-9-12-2-1-7-18-12)11-3-4-13-10(8-11)5-6-15-13/h3-6,8,12,15H,1-2,7,9H2,(H,16,17).
What are the key properties of N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide?
N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide is sourced from PubChem (CID 63717299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).