1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine

C14H17ClN2 — CID 117375026

IUPAC1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine
SMILESCc1cc2c(Cl)c(C3(C(C)N)CC3)ccc2[nH]1
InChIInChI=1S/C14H17ClN2/c1-8-7-10-12(17-8)4-3-11(13(10)15)14(5-6-14)9(2)16/h3-4,7,9,17H,5-6,16H2,1-2H3
InChIKeyDNLGQFURKMZXNA-UHFFFAOYSA-N
MW248.76 g/mol
LogP3.51
Rot. Bonds2

About 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine

1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine (PubChem CID 117375026) has the molecular formula C14H17ClN2 and a molecular weight of 248.76 g/mol. Its IUPAC name is 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine
PubChem CID117375026
Molecular FormulaC14H17ClN2
Molecular Weight248.76 g/mol
Exact Mass248.11
IUPAC Name1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine
SMILESCc1cc2c(Cl)c(C3(C(C)N)CC3)ccc2[nH]1
InChIInChI=1S/C14H17ClN2/c1-8-7-10-12(17-8)4-3-11(13(10)15)14(5-6-14)9(2)16/h3-4,7,9,17H,5-6,16H2,1-2H3
InChIKeyDNLGQFURKMZXNA-UHFFFAOYSA-N
XLogP3.51
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.76
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine 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

1-[1-[2-(trifluoromethyl)-1H-indol-4-yl]cyclopropyl]ethanamine
CID 117424154
(4-chloro-2-methyl-1H-indol-5-yl)methanol
CID 84666570
1-[1-(4-fluoro-2-methylphenyl)cyclopropyl]ethanamine
CID 117283964
6-[1-(1-aminoethyl)cyclopropyl]-2-chloro-3,4-dimethylphenol
CID 117352069
1-[1-(5-bromo-2-chlorophenyl)cyclopropyl]ethanamine
CID 117439047
4-chloro-2-methyl-1H-indole-5-carboxylic acid
CID 82612258
4-chloro-2-methyl-5-piperidin-4-yl-1H-indole
CID 115004432
[3-(4-chloro-2-methyl-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117411456
1-[1-(9,11-diazatetracyclo[9.2.2.02,10.03,8]pentadeca-2(10),3(8),4,6-tetraen-5-yl)cyclopropyl]ethanamine
CID 117451856
3-(4-chloro-2-methyl-1H-indol-5-yl)propan-1-ol
CID 117321063
1-[1-(3-bromo-2-methoxy-4-methylphenyl)cyclopropyl]ethanamine
CID 117457314
4-amino-2-methyl-1H-indol-5-ol
CID 82415321

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine?
The IUPAC name of 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine (CID 117375026) is 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine.
What is the SMILES notation for 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine?
The canonical SMILES for 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine is Cc1cc2c(Cl)c(C3(C(C)N)CC3)ccc2[nH]1.
What is the InChIKey of 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine?
The InChIKey is DNLGQFURKMZXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2/c1-8-7-10-12(17-8)4-3-11(13(10)15)14(5-6-14)9(2)16/h3-4,7,9,17H,5-6,16H2,1-2H3.
What are the key properties of 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine?
1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine has a molecular weight of 248.76 g/mol, XLogP of 3.51, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-chloro-2-methyl-1H-indol-5-yl)cyclopropyl]ethanamine is sourced from PubChem (CID 117375026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).