N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide

C15H18N2O2 — CID 115759610

IUPACN-(4-methyloxan-4-yl)-1H-indole-5-carboxamide
SMILESCC1(NC(=O)c2ccc3[nH]ccc3c2)CCOCC1
InChIInChI=1S/C15H18N2O2/c1-15(5-8-19-9-6-15)17-14(18)12-2-3-13-11(10-12)4-7-16-13/h2-4,7,10,16H,5-6,8-9H2,1H3,(H,17,18)
InChIKeyPWUYKVZTJCLFNE-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.47
Rot. Bonds2

About N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide

N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide (PubChem CID 115759610) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methyloxan-4-yl)-1H-indole-5-carboxamide
PubChem CID115759610
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(4-methyloxan-4-yl)-1H-indole-5-carboxamide
SMILESCC1(NC(=O)c2ccc3[nH]ccc3c2)CCOCC1
InChIInChI=1S/C15H18N2O2/c1-15(5-8-19-9-6-15)17-14(18)12-2-3-13-11(10-12)4-7-16-13/h2-4,7,10,16H,5-6,8-9H2,1H3,(H,17,18)
InChIKeyPWUYKVZTJCLFNE-UHFFFAOYSA-N
XLogP2.47
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
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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Frequently Asked Questions

What is the IUPAC name of N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide?
The IUPAC name of N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide (CID 115759610) is N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide is CC1(NC(=O)c2ccc3[nH]ccc3c2)CCOCC1.
What is the InChIKey of N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide?
The InChIKey is PWUYKVZTJCLFNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-15(5-8-19-9-6-15)17-14(18)12-2-3-13-11(10-12)4-7-16-13/h2-4,7,10,16H,5-6,8-9H2,1H3,(H,17,18).
What are the key properties of N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide?
N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyloxan-4-yl)-1H-indole-5-carboxamide is sourced from PubChem (CID 115759610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).