1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine

C10H13ClN2 — CID 83868576

IUPAC1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine
SMILESCNCC1Cc2cc(Cl)ccc2N1
InChIInChI=1S/C10H13ClN2/c1-12-6-9-5-7-4-8(11)2-3-10(7)13-9/h2-4,9,12-13H,5-6H2,1H3
InChIKeyTYDOXBGIHPITLT-UHFFFAOYSA-N
MW196.68 g/mol
LogP1.90
Rot. Bonds2

About 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine

1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine (PubChem CID 83868576) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine
PubChem CID83868576
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine
SMILESCNCC1Cc2cc(Cl)ccc2N1
InChIInChI=1S/C10H13ClN2/c1-12-6-9-5-7-4-8(11)2-3-10(7)13-9/h2-4,9,12-13H,5-6H2,1H3
InChIKeyTYDOXBGIHPITLT-UHFFFAOYSA-N
XLogP1.90
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylpropan-2-amine
CID 117201101
5-chloro-2-(trifluoromethyl)-2,3-dihydro-1H-indole
CID 83486702
2-(methylaminomethyl)-1,2,3,4-tetrahydroquinolin-6-ol
CID 105446256
N-methyl-1-[6-(trifluoromethyl)-2,3-dihydro-1H-indol-2-yl]methanamine
CID 117202732
ethyl (2R)-5-chloro-2,3-dihydro-1H-indole-2-carboxylate
CID 142661958
methyl (2R)-5-chloro-2,3-dihydro-1H-indole-2-carboxylate
CID 21344957
1-(6-chloro-1,2,3,4-tetrahydroquinolin-4-yl)-N-methylmethanamine
CID 105464651
tert-butyl N-[(6-chloro-1,2,3,4-tetrahydroquinolin-2-yl)methyl]carbamate
CID 19958483
N-[(6-chloro-1,2,3,4-tetrahydroquinolin-3-yl)methyl]ethanamine
CID 105482686
7-chloro-2-ethenyl-2,3,4,5-tetrahydro-1H-1-benzazepin-4-ol
CID 90723595
3-(methylaminomethyl)-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 105446246
6-chloro-2-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 21445338

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine (CID 83868576) is 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine is CNCC1Cc2cc(Cl)ccc2N1.
What is the InChIKey of 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine?
The InChIKey is TYDOXBGIHPITLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2/c1-12-6-9-5-7-4-8(11)2-3-10(7)13-9/h2-4,9,12-13H,5-6H2,1H3.
What are the key properties of 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine?
1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine has a molecular weight of 196.68 g/mol, XLogP of 1.90, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylmethanamine is sourced from PubChem (CID 83868576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).