3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine

C16H24N2 — CID 83948548

IUPAC3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine
SMILESCCCc1cn(CCCN)c2c(C)ccc(C)c12
InChIInChI=1S/C16H24N2/c1-4-6-14-11-18(10-5-9-17)16-13(3)8-7-12(2)15(14)16/h7-8,11H,4-6,9-10,17H2,1-3H3
InChIKeyBYEQUOZGJZQMJC-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.56
Rot. Bonds5

About 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine

3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine (PubChem CID 83948548) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine
PubChem CID83948548
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine
SMILESCCCc1cn(CCCN)c2c(C)ccc(C)c12
InChIInChI=1S/C16H24N2/c1-4-6-14-11-18(10-5-9-17)16-13(3)8-7-12(2)15(14)16/h7-8,11H,4-6,9-10,17H2,1-3H3
InChIKeyBYEQUOZGJZQMJC-UHFFFAOYSA-N
XLogP3.56
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine 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

3-[1-(3-aminopropyl)-4,7-dimethylindol-3-yl]propan-1-ol
CID 83944932
2-(4,7-dimethyl-3-propylindol-1-yl)ethanol
CID 83944887
3-(5,7-dimethyl-3-propylindol-1-yl)propan-1-amine
CID 83948572
1-[1-(3-aminopropyl)-4,7-dimethylindol-3-yl]ethanol
CID 83944930
3-(7-methoxy-1,4-dimethylindol-3-yl)propan-1-amine
CID 82495903
1-(3-aminopropyl)-3-ethyl-4,7-dimethylindole-5-carboxylic acid
CID 83963356
3-(5-ethyl-3-propylindol-1-yl)propan-1-amine
CID 83948753
3-(1-ethyl-7-methylindol-3-yl)propan-1-amine
CID 117197455
1-(1-butyl-4,7-dimethylindol-3-yl)ethanol
CID 83944914
3-(1,3,4,7-tetramethylindol-2-yl)propan-1-amine
CID 83859861
3-[4,6-dimethyl-3-(2-pyrrolidin-1-ylethyl)indol-1-yl]propan-1-amine
CID 83948930
3-[1-(3-aminopropyl)-5,7-dimethylindol-3-yl]propan-1-ol
CID 83944989

Frequently Asked Questions

What is the IUPAC name of 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine?
The IUPAC name of 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine (CID 83948548) is 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine?
The canonical SMILES for 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine is CCCc1cn(CCCN)c2c(C)ccc(C)c12.
What is the InChIKey of 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine?
The InChIKey is BYEQUOZGJZQMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-4-6-14-11-18(10-5-9-17)16-13(3)8-7-12(2)15(14)16/h7-8,11H,4-6,9-10,17H2,1-3H3.
What are the key properties of 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine?
3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine has a molecular weight of 244.38 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine is sourced from PubChem (CID 83948548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).