1-(1H-indol-7-yl)ethanamine

C10H12N2 — CID 68767780

IUPAC1-(1H-indol-7-yl)ethanamine
SMILESCC(N)c1cccc2cc[nH]c12
InChIInChI=1S/C10H12N2/c1-7(11)9-4-2-3-8-5-6-12-10(8)9/h2-7,12H,11H2,1H3
InChIKeyPFUMIOHIKRRVEE-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.19
Rot. Bonds1

About 1-(1H-indol-7-yl)ethanamine

1-(1H-indol-7-yl)ethanamine (PubChem CID 68767780) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 1-(1H-indol-7-yl)ethanamine.

Molecular Properties

Compound Name1-(1H-indol-7-yl)ethanamine
PubChem CID68767780
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name1-(1H-indol-7-yl)ethanamine
SMILESCC(N)c1cccc2cc[nH]c12
InChIInChI=1S/C10H12N2/c1-7(11)9-4-2-3-8-5-6-12-10(8)9/h2-7,12H,11H2,1H3
InChIKeyPFUMIOHIKRRVEE-UHFFFAOYSA-N
XLogP2.19
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-(1H-indol-7-yl)propan-1-amine
CID 55254624
1-amino-1-(1H-indol-7-yl)propan-2-one
CID 55270531
2-(1H-indol-7-yl)-3-methylbutanoic acid
CID 82614338
(3S)-3-(1H-indol-7-yl)butanoic acid
CID 96762196
methyl (3R)-3-amino-3-(1H-indol-7-yl)propanoate
CID 165356161
4-amino-4-(1H-indol-7-yl)butanoic acid
CID 82614845
2-hydroxy-2-(1H-indol-7-yl)acetic acid
CID 82403712
4-bromo-1-(1H-indol-7-yl)butane-1,2-diol
CID 171892180
ethane;hydrazine;7-methyl-1H-indole
CID 91172685
7-[bis(phenylsulfanyl)methyl]-1H-indole
CID 132522619
2,3-dihydroxy-3-(1H-indol-7-yl)propanenitrile
CID 171870401
N-propan-2-yl-1H-indol-7-amine
CID 83481688

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-7-yl)ethanamine?
The IUPAC name of 1-(1H-indol-7-yl)ethanamine (CID 68767780) is 1-(1H-indol-7-yl)ethanamine.
What is the SMILES notation for 1-(1H-indol-7-yl)ethanamine?
The canonical SMILES for 1-(1H-indol-7-yl)ethanamine is CC(N)c1cccc2cc[nH]c12.
What is the InChIKey of 1-(1H-indol-7-yl)ethanamine?
The InChIKey is PFUMIOHIKRRVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-7(11)9-4-2-3-8-5-6-12-10(8)9/h2-7,12H,11H2,1H3.
What are the key properties of 1-(1H-indol-7-yl)ethanamine?
1-(1H-indol-7-yl)ethanamine has a molecular weight of 160.22 g/mol, XLogP of 2.19, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-7-yl)ethanamine is sourced from PubChem (CID 68767780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).