1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide

C21H30N2O2 — CID 17429408

IUPAC1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide
SMILESCOc1ccc2c(c1)c(C(=O)NC(C)CCC(C)C)c(C)n2C1CC1
InChIInChI=1S/C21H30N2O2/c1-13(2)6-7-14(3)22-21(24)20-15(4)23(16-8-9-16)19-11-10-17(25-5)12-18(19)20/h10-14,16H,6-9H2,1-5H3,(H,22,24)
InChIKeyWWEMJUPHCHNDGM-UHFFFAOYSA-N
MW342.48 g/mol
LogP4.85
Rot. Bonds7

About 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide

1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide (PubChem CID 17429408) has the molecular formula C21H30N2O2 and a molecular weight of 342.48 g/mol. Its IUPAC name is 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide
PubChem CID17429408
Molecular FormulaC21H30N2O2
Molecular Weight342.48 g/mol
Exact Mass342.23
IUPAC Name1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide
SMILESCOc1ccc2c(c1)c(C(=O)NC(C)CCC(C)C)c(C)n2C1CC1
InChIInChI=1S/C21H30N2O2/c1-13(2)6-7-14(3)22-21(24)20-15(4)23(16-8-9-16)19-11-10-17(25-5)12-18(19)20/h10-14,16H,6-9H2,1-5H3,(H,22,24)
InChIKeyWWEMJUPHCHNDGM-UHFFFAOYSA-N
XLogP4.85
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.48
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclohexyl-5-methoxy-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)indole-3-carboxamide
CID 112827378
3-oxobutan-2-yl 1-cyclopropyl-5-methoxy-2-methylindole-3-carboxylate
CID 18281159
1-cyclohexyl-N-(2-hydroxyethyl)-5-methoxy-2-methylindole-3-carboxamide
CID 110878033
1-cyclohexyl-5-methoxy-2-methyl-N-(1-pyridin-3-ylethyl)indole-3-carboxamide
CID 112772126
1-cyclohexyl-5-methoxy-2-methylindole-3-carboxylate
CID 6954360
1-cyclohexyl-5-methoxy-2-methyl-N-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]indole-3-carboxamide
CID 112799090
1-cyclohexyl-N-(1-ethylpyrazol-4-yl)-5-methoxy-2-methylindole-3-carboxamide
CID 112820627
N-[4-(3-amino-3-oxopropoxy)phenyl]-1-cyclohexyl-5-methoxy-2-methylindole-3-carboxamide
CID 112842247
1-cyclohexyl-N-[2-(dimethylamino)-1-(2-methylphenyl)ethyl]-5-methoxy-2-methylindole-3-carboxamide;2,2,2-trifluoroacetic acid
CID 166326615
1-cyclohexyl-5-methoxy-2-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]indole-3-carboxamide
CID 112795503
1-cyclopentyl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-5-methoxy-2-methylindole-3-carboxamide
CID 131962261
1-cyclohexyl-5-methoxy-2-methyl-N-(3-morpholin-4-yl-3-oxopropyl)indole-3-carboxamide
CID 112815425

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide?
The IUPAC name of 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide (CID 17429408) is 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide.
What is the SMILES notation for 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide?
The canonical SMILES for 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide is COc1ccc2c(c1)c(C(=O)NC(C)CCC(C)C)c(C)n2C1CC1.
What is the InChIKey of 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide?
The InChIKey is WWEMJUPHCHNDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O2/c1-13(2)6-7-14(3)22-21(24)20-15(4)23(16-8-9-16)19-11-10-17(25-5)12-18(19)20/h10-14,16H,6-9H2,1-5H3,(H,22,24).
What are the key properties of 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide?
1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide has a molecular weight of 342.48 g/mol, XLogP of 4.85, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-methoxy-2-methyl-N-(5-methylhexan-2-yl)indole-3-carboxamide is sourced from PubChem (CID 17429408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).