2-(1-methylindol-3-yl)-N-propan-2-ylacetamide

C14H18N2O — CID 13010552

IUPAC2-(1-methylindol-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cc1cn(C)c2ccccc12
InChIInChI=1S/C14H18N2O/c1-10(2)15-14(17)8-11-9-16(3)13-7-5-4-6-12(11)13/h4-7,9-10H,8H2,1-3H3,(H,15,17)
InChIKeyLOVBOFFEDHYCMQ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.25
Rot. Bonds3

About 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide

2-(1-methylindol-3-yl)-N-propan-2-ylacetamide (PubChem CID 13010552) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(1-methylindol-3-yl)-N-propan-2-ylacetamide
PubChem CID13010552
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name2-(1-methylindol-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cc1cn(C)c2ccccc12
InChIInChI=1S/C14H18N2O/c1-10(2)15-14(17)8-11-9-16(3)13-7-5-4-6-12(11)13/h4-7,9-10H,8H2,1-3H3,(H,15,17)
InChIKeyLOVBOFFEDHYCMQ-UHFFFAOYSA-N
XLogP2.25
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
CID 110847846
N-[(1-methylindol-3-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 115158236
N-(2-aminopropyl)-2-(1-methylindol-3-yl)acetamide
CID 110832860
3-methyl-N-[4-[[2-(1-methylindol-3-yl)acetyl]amino]phenyl]butanamide
CID 47078833
N-[1-(4-chlorophenyl)-2-hydroxyethyl]-2-(1-methylindol-3-yl)acetamide
CID 110004624
N-(2-aminoethyl)-2-(1-methylindol-3-yl)acetamide
CID 82289252
2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide
CID 4523425
N-(2-ethylphenyl)-2-(1-methylindol-3-yl)acetamide
CID 4523543
N-(2-methoxyethyl)-2-(1-methylindol-3-yl)acetamide
CID 3237946
N-[(4-fluorophenyl)methyl]-2-(1-methylindol-3-yl)acetamide
CID 3632445
N-but-3-ynyl-2-(1-methylindol-3-yl)acetamide
CID 90537865
3-amino-2-methyl-N-[(1-methylindol-3-yl)methyl]propanamide
CID 115153662

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide (CID 13010552) is 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cc1cn(C)c2ccccc12.
What is the InChIKey of 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide?
The InChIKey is LOVBOFFEDHYCMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-10(2)15-14(17)8-11-9-16(3)13-7-5-4-6-12(11)13/h4-7,9-10H,8H2,1-3H3,(H,15,17).
What are the key properties of 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide?
2-(1-methylindol-3-yl)-N-propan-2-ylacetamide has a molecular weight of 230.31 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-3-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 13010552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).