2-(7-chloro-1-methylindol-2-yl)propan-1-amine

C12H15ClN2 — CID 83868392

IUPAC2-(7-chloro-1-methylindol-2-yl)propan-1-amine
SMILESCC(CN)c1cc2cccc(Cl)c2n1C
InChIInChI=1S/C12H15ClN2/c1-8(7-14)11-6-9-4-3-5-10(13)12(9)15(11)2/h3-6,8H,7,14H2,1-2H3
InChIKeyWWOFJJKBJZRDDX-UHFFFAOYSA-N
MW222.72 g/mol
LogP2.89
Rot. Bonds2

About 2-(7-chloro-1-methylindol-2-yl)propan-1-amine

2-(7-chloro-1-methylindol-2-yl)propan-1-amine (PubChem CID 83868392) has the molecular formula C12H15ClN2 and a molecular weight of 222.72 g/mol. Its IUPAC name is 2-(7-chloro-1-methylindol-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-(7-chloro-1-methylindol-2-yl)propan-1-amine
PubChem CID83868392
Molecular FormulaC12H15ClN2
Molecular Weight222.72 g/mol
Exact Mass222.09
IUPAC Name2-(7-chloro-1-methylindol-2-yl)propan-1-amine
SMILESCC(CN)c1cc2cccc(Cl)c2n1C
InChIInChI=1S/C12H15ClN2/c1-8(7-14)11-6-9-4-3-5-10(13)12(9)15(11)2/h3-6,8H,7,14H2,1-2H3
InChIKeyWWOFJJKBJZRDDX-UHFFFAOYSA-N
XLogP2.89
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.72
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(7-chloro-1-methylindol-2-yl)butan-1-amine
CID 83868398
2-(7-chloro-1,2-dimethylindol-3-yl)propan-1-amine
CID 82496910
(7-chloro-1-methylindol-2-yl)methanethiol
CID 117183833
2-(7-chloro-1,3-dimethylindol-2-yl)propan-1-amine
CID 83868342
7-chloro-1-methyl-N-propan-2-ylindole-2-carboxamide
CID 110847862
2-(8-chloro-1-methyl-2-oxoquinolin-3-yl)propanenitrile
CID 84632651
5-(7-chloro-1-methylindol-2-yl)-1,2-oxazol-3-amine
CID 115107942
8-chloro-1-methyl-2-oxoquinoline-3-carboxylic acid
CID 115042327
2-(5-chloro-1-ethylindol-2-yl)propan-1-amine
CID 117121588
(2S)-2-(4-chloro-1H-benzimidazol-2-yl)propan-1-amine
CID 94542564
7-chloro-N,N-diethyl-1-methylindole-2-carboxamide
CID 110855125
7-chloro-2-(methylsulfanylmethyl)-1-propan-2-ylindole
CID 117184313

Frequently Asked Questions

What is the IUPAC name of 2-(7-chloro-1-methylindol-2-yl)propan-1-amine?
The IUPAC name of 2-(7-chloro-1-methylindol-2-yl)propan-1-amine (CID 83868392) is 2-(7-chloro-1-methylindol-2-yl)propan-1-amine.
What is the SMILES notation for 2-(7-chloro-1-methylindol-2-yl)propan-1-amine?
The canonical SMILES for 2-(7-chloro-1-methylindol-2-yl)propan-1-amine is CC(CN)c1cc2cccc(Cl)c2n1C.
What is the InChIKey of 2-(7-chloro-1-methylindol-2-yl)propan-1-amine?
The InChIKey is WWOFJJKBJZRDDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2/c1-8(7-14)11-6-9-4-3-5-10(13)12(9)15(11)2/h3-6,8H,7,14H2,1-2H3.
What are the key properties of 2-(7-chloro-1-methylindol-2-yl)propan-1-amine?
2-(7-chloro-1-methylindol-2-yl)propan-1-amine has a molecular weight of 222.72 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloro-1-methylindol-2-yl)propan-1-amine is sourced from PubChem (CID 83868392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).