N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide

C19H26N2O — CID 6498753

IUPACN-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide
SMILESCCn1c(CNC(=O)C2CCCCC2)cc2cc(C)ccc21
InChIInChI=1S/C19H26N2O/c1-3-21-17(12-16-11-14(2)9-10-18(16)21)13-20-19(22)15-7-5-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,20,22)
InChIKeyGUDCKTFQQPEGEE-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.17
Rot. Bonds4

About N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide

N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide (PubChem CID 6498753) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide
PubChem CID6498753
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC NameN-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide
SMILESCCn1c(CNC(=O)C2CCCCC2)cc2cc(C)ccc21
InChIInChI=1S/C19H26N2O/c1-3-21-17(12-16-11-14(2)9-10-18(16)21)13-20-19(22)15-7-5-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,20,22)
InChIKeyGUDCKTFQQPEGEE-UHFFFAOYSA-N
XLogP4.17
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide?
The IUPAC name of N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide (CID 6498753) is N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide?
The canonical SMILES for N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide is CCn1c(CNC(=O)C2CCCCC2)cc2cc(C)ccc21.
What is the InChIKey of N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide?
The InChIKey is GUDCKTFQQPEGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-3-21-17(12-16-11-14(2)9-10-18(16)21)13-20-19(22)15-7-5-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,20,22).
What are the key properties of N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide?
N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide has a molecular weight of 298.43 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-5-methylindol-2-yl)methyl]cyclohexanecarboxamide is sourced from PubChem (CID 6498753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).