2-(1H-indol-5-yl)propanamide

C11H12N2O — CID 140559721

IUPAC2-(1H-indol-5-yl)propanamide
SMILESCC(C(N)=O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C11H12N2O/c1-7(11(12)14)8-2-3-10-9(6-8)4-5-13-10/h2-7,13H,1H3,(H2,12,14)
InChIKeyCGLNLHSHHLENFU-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.76
Rot. Bonds2

About 2-(1H-indol-5-yl)propanamide

2-(1H-indol-5-yl)propanamide (PubChem CID 140559721) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(1H-indol-5-yl)propanamide.

Molecular Properties

Compound Name2-(1H-indol-5-yl)propanamide
PubChem CID140559721
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name2-(1H-indol-5-yl)propanamide
SMILESCC(C(N)=O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C11H12N2O/c1-7(11(12)14)8-2-3-10-9(6-8)4-5-13-10/h2-7,13H,1H3,(H2,12,14)
InChIKeyCGLNLHSHHLENFU-UHFFFAOYSA-N
XLogP1.76
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

5-propan-2-yl-1H-indole
CID 10558918
methyl (2R)-2-amino-2-(1H-indol-5-yl)acetate
CID 131526259
5-(1-chloroethyl)-1H-indole
CID 174700849
hexanedioic acid;bis(1-(1H-indol-5-yl)ethanamine)
CID 15140319
(2R)-2-naphthalen-2-ylpropanamide
CID 101175106
(1R)-1-(1H-indol-5-yl)-N-methylethanamine
CID 55276552
methyl (3R)-3-amino-3-(1H-indol-5-yl)-2,2-dimethylpropanoate;hydrochloride
CID 171241452
methyl (3S)-3-amino-3-(1H-indol-5-yl)-2,2-dimethylpropanoate;hydrochloride
CID 171248172
5-butan-2-yl-1H-indole;molecular hydrogen
CID 144711250
(Z)-2,4-dihydroxy-4-(1H-indol-5-yl)but-2-enoic acid
CID 141265593
(E)-2,4-dihydroxy-4-(1H-indol-5-yl)but-2-enoic acid
CID 141342745
2-acetamido-N-[(1S)-1-(1H-indol-5-yl)ethyl]-2-methylpropanamide
CID 126433779

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-5-yl)propanamide?
The IUPAC name of 2-(1H-indol-5-yl)propanamide (CID 140559721) is 2-(1H-indol-5-yl)propanamide.
What is the SMILES notation for 2-(1H-indol-5-yl)propanamide?
The canonical SMILES for 2-(1H-indol-5-yl)propanamide is CC(C(N)=O)c1ccc2[nH]ccc2c1.
What is the InChIKey of 2-(1H-indol-5-yl)propanamide?
The InChIKey is CGLNLHSHHLENFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-7(11(12)14)8-2-3-10-9(6-8)4-5-13-10/h2-7,13H,1H3,(H2,12,14).
What are the key properties of 2-(1H-indol-5-yl)propanamide?
2-(1H-indol-5-yl)propanamide has a molecular weight of 188.23 g/mol, XLogP of 1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-5-yl)propanamide is sourced from PubChem (CID 140559721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).