N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide

C19H26N2O — CID 113084050

IUPACN-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide
SMILESCC(C)(CNC(=O)C1CCCCC1)c1c[nH]c2ccccc12
InChIInChI=1S/C19H26N2O/c1-19(2,13-21-18(22)14-8-4-3-5-9-14)16-12-20-17-11-7-6-10-15(16)17/h6-7,10-12,14,20H,3-5,8-9,13H2,1-2H3,(H,21,22)
InChIKeyGFPWTVUTKBFJIS-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.14
Rot. Bonds4

About N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide

N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide (PubChem CID 113084050) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide
PubChem CID113084050
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC NameN-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide
SMILESCC(C)(CNC(=O)C1CCCCC1)c1c[nH]c2ccccc12
InChIInChI=1S/C19H26N2O/c1-19(2,13-21-18(22)14-8-4-3-5-9-14)16-12-20-17-11-7-6-10-15(16)17/h6-7,10-12,14,20H,3-5,8-9,13H2,1-2H3,(H,21,22)
InChIKeyGFPWTVUTKBFJIS-UHFFFAOYSA-N
XLogP4.14
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(6-fluoro-1H-indol-3-yl)-2-methylpropyl]cyclobutanecarboxamide
CID 113084487
[2-(1H-indol-3-yl)-2-methylpropyl]urea
CID 115168791
N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide
CID 113084044
1-[2-(1H-indol-3-yl)-2-methylpropyl]-3-propan-2-ylurea
CID 113084112
N-[2-(5-methoxy-1H-indol-3-yl)-2-methylpropyl]cyclopropanecarboxamide
CID 113084339
3-amino-N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide
CID 115153153
N-[2-(1H-indol-3-yl)-2-methylpropyl]-2-(4-methylphenyl)acetamide
CID 113084102
2-[[2-(1H-indol-3-yl)-2-methylpropyl]amino]acetic acid
CID 115218163
N-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxoethyl]cyclohexanecarboxamide
CID 24599123
2-(3-bromophenyl)-N-[2-(1H-indol-3-yl)-2-methylpropyl]acetamide
CID 113084108
N-(2-hydroxy-2-methylpropyl)cyclohexanecarboxamide
CID 65109688
methyl (2R)-2-[[2-(cyclohexanecarbonylamino)acetyl]amino]-3-(1H-indol-3-yl)propanoate
CID 18105767

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide (CID 113084050) is N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide is CC(C)(CNC(=O)C1CCCCC1)c1c[nH]c2ccccc12.
What is the InChIKey of N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide?
The InChIKey is GFPWTVUTKBFJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-19(2,13-21-18(22)14-8-4-3-5-9-14)16-12-20-17-11-7-6-10-15(16)17/h6-7,10-12,14,20H,3-5,8-9,13H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide?
N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide has a molecular weight of 298.43 g/mol, XLogP of 4.14, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide is sourced from PubChem (CID 113084050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).