3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine

C19H23N3 — CID 83975876

IUPAC3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine
SMILESCCn1c(C)c(CC(CN)c2ccccn2)c2ccccc21
InChIInChI=1S/C19H23N3/c1-3-22-14(2)17(16-8-4-5-10-19(16)22)12-15(13-20)18-9-6-7-11-21-18/h4-11,15H,3,12-13,20H2,1-2H3
InChIKeyPSHWPOZNHDGOHH-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.65
Rot. Bonds5

About 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine

3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine (PubChem CID 83975876) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine
PubChem CID83975876
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC Name3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine
SMILESCCn1c(C)c(CC(CN)c2ccccn2)c2ccccc21
InChIInChI=1S/C19H23N3/c1-3-22-14(2)17(16-8-4-5-10-19(16)22)12-15(13-20)18-9-6-7-11-21-18/h4-11,15H,3,12-13,20H2,1-2H3
InChIKeyPSHWPOZNHDGOHH-UHFFFAOYSA-N
XLogP3.65
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

4-[1-amino-3-(1-ethyl-2-methylindol-3-yl)propan-2-yl]phenol
CID 83975448
3-(1-ethyl-2-methylindol-3-yl)-2-(4-methoxyphenyl)propan-1-amine
CID 83972544
3-(1-ethyl-2-methylindol-3-yl)-2-(5-fluoro-1H-indol-3-yl)propan-1-amine
CID 112539142
3-(3-methylphenyl)-2-pyridin-2-ylpropan-1-amine
CID 82080996
2,3-bis(1,2-dimethylindol-3-yl)propan-1-amine
CID 112539162
3-(4-ethoxyphenyl)-2-pyridin-2-ylpropan-1-amine
CID 112509068
3-(3,5-dichloro-4-ethoxyphenyl)-2-pyridin-2-ylpropan-1-amine
CID 83975851
3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine
CID 82094286
3-(4-propoxyphenyl)-2-pyridin-2-ylpropan-1-amine
CID 83975865
CID 163999461
CID 163999461
4-methyl-2-pyridin-2-ylheptan-1-amine
CID 54593230
3-(1-ethyl-2-methylindol-3-yl)-N,N-dimethylpropan-1-amine
CID 170866943

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine (CID 83975876) is 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine is CCn1c(C)c(CC(CN)c2ccccn2)c2ccccc21.
What is the InChIKey of 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine?
The InChIKey is PSHWPOZNHDGOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-3-22-14(2)17(16-8-4-5-10-19(16)22)12-15(13-20)18-9-6-7-11-21-18/h4-11,15H,3,12-13,20H2,1-2H3.
What are the key properties of 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine?
3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine has a molecular weight of 293.41 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyl-2-methylindol-3-yl)-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 83975876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).