N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide

C17H22N2O — CID 6498693

IUPACN-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide
SMILESCn1c(CNC(=O)C2CCCCC2)cc2ccccc21
InChIInChI=1S/C17H22N2O/c1-19-15(11-14-9-5-6-10-16(14)19)12-18-17(20)13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3,(H,18,20)
InChIKeyQFHDWQYPTDKNBG-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.37
Rot. Bonds3

About N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide

N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide (PubChem CID 6498693) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide
PubChem CID6498693
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide
SMILESCn1c(CNC(=O)C2CCCCC2)cc2ccccc21
InChIInChI=1S/C17H22N2O/c1-19-15(11-14-9-5-6-10-16(14)19)12-18-17(20)13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3,(H,18,20)
InChIKeyQFHDWQYPTDKNBG-UHFFFAOYSA-N
XLogP3.37
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide?
The IUPAC name of N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide (CID 6498693) is N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide?
The canonical SMILES for N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide is Cn1c(CNC(=O)C2CCCCC2)cc2ccccc21.
What is the InChIKey of N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide?
The InChIKey is QFHDWQYPTDKNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-19-15(11-14-9-5-6-10-16(14)19)12-18-17(20)13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3,(H,18,20).
What are the key properties of N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide?
N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide has a molecular weight of 270.38 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylindol-2-yl)methyl]cyclohexanecarboxamide is sourced from PubChem (CID 6498693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).