3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide

C18H24N2O — CID 43420888

IUPAC3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide
SMILESCC1CCCC(NC(=O)CCc2c[nH]c3ccccc23)C1
InChIInChI=1S/C18H24N2O/c1-13-5-4-6-15(11-13)20-18(21)10-9-14-12-19-17-8-3-2-7-16(14)17/h2-3,7-8,12-13,15,19H,4-6,9-11H2,1H3,(H,20,21)
InChIKeyWSZZAOSAGCQOJG-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.80
Rot. Bonds4

About 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide

3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide (PubChem CID 43420888) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide
PubChem CID43420888
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide
SMILESCC1CCCC(NC(=O)CCc2c[nH]c3ccccc23)C1
InChIInChI=1S/C18H24N2O/c1-13-5-4-6-15(11-13)20-18(21)10-9-14-12-19-17-8-3-2-7-16(14)17/h2-3,7-8,12-13,15,19H,4-6,9-11H2,1H3,(H,20,21)
InChIKeyWSZZAOSAGCQOJG-UHFFFAOYSA-N
XLogP3.80
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-(1H-indol-3-yl)-N-(2-methylpiperidin-4-yl)propanamide
CID 106995348
3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide
CID 47161541
N-cyclohexyl-5-(1H-indol-3-yl)pentanamide
CID 140983117
cis-(1R,3S)-3-[4-(1H-indol-3-yl)butanoylamino]cyclopentane-1-carboxylic acid
CID 120679084
N-cyclopropyl-4-(1H-indol-3-yl)butanamide
CID 729220
3-(1H-indol-3-yl)-N-[1-(pyrrolidine-1-carbonyl)piperidin-4-yl]propanamide
CID 91765115
N-(3,4-dimethylcyclohexyl)-2-(1H-indol-3-yl)acetamide
CID 64742201
N-(3-methylcyclohexyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 134005284
4-(1H-indol-3-yl)-N-piperidin-3-ylbutanamide
CID 63321297
N'-cyclopentyl-N-[2-(1H-indol-3-yl)ethyl]propanediamide
CID 108942165
3-(1H-indol-3-yl)-N-(1-oxaspiro[4.5]decan-3-yl)propanamide
CID 91833615
2-(1H-indol-3-yl)ethyl-[(1R,3R)-3-methylcyclohexyl]azanium
CID 7445932

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide (CID 43420888) is 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide is CC1CCCC(NC(=O)CCc2c[nH]c3ccccc23)C1.
What is the InChIKey of 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide?
The InChIKey is WSZZAOSAGCQOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13-5-4-6-15(11-13)20-18(21)10-9-14-12-19-17-8-3-2-7-16(14)17/h2-3,7-8,12-13,15,19H,4-6,9-11H2,1H3,(H,20,21).
What are the key properties of 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide?
3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide has a molecular weight of 284.40 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-(3-methylcyclohexyl)propanamide is sourced from PubChem (CID 43420888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).