N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine

C14H22N2 — CID 115105803

IUPACN-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine
SMILESCCCN1CCc2ccc(CCNC)cc21
InChIInChI=1S/C14H22N2/c1-3-9-16-10-7-13-5-4-12(6-8-15-2)11-14(13)16/h4-5,11,15H,3,6-10H2,1-2H3
InChIKeyIBABSZPSSRRQJF-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.22
Rot. Bonds5

About N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine

N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine (PubChem CID 115105803) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine
PubChem CID115105803
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine
SMILESCCCN1CCc2ccc(CCNC)cc21
InChIInChI=1S/C14H22N2/c1-3-9-16-10-7-13-5-4-12(6-8-15-2)11-14(13)16/h4-5,11,15H,3,6-10H2,1-2H3
InChIKeyIBABSZPSSRRQJF-UHFFFAOYSA-N
XLogP2.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(cyclobutylmethyl)-2,3-dihydroindol-6-yl]-N-methylethanamine
CID 115105814
7-(2-piperazin-1-ylethyl)-1-propyl-3,4-dihydro-2H-quinoline
CID 82263573
azane;6-methylsulfanyl-1-propyl-2,3-dihydroindole
CID 66838232
4-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylbutan-1-amine
CID 103497056
5-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylpentan-1-amine
CID 103503121
N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine
CID 115105770
3-(1-ethyl-2,3-dihydroindol-6-yl)propanoic acid
CID 115105873
N,1-dipentyl-2,3-dihydroindol-6-amine
CID 70410805
1-methyl-5-propyl-2,3-dihydroindole
CID 89046240
N-methyl-2-(2-propan-2-yl-1,3-dihydroisoindol-5-yl)ethanamine
CID 83836841
1-(1-ethyl-2,3-dihydroindol-6-yl)propan-2-one
CID 115105745
azane;but-2-enedioic acid;6-chloro-1-propyl-2,3-dihydroindole
CID 70160075

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine?
The IUPAC name of N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine (CID 115105803) is N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine?
The canonical SMILES for N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine is CCCN1CCc2ccc(CCNC)cc21.
What is the InChIKey of N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine?
The InChIKey is IBABSZPSSRRQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-3-9-16-10-7-13-5-4-12(6-8-15-2)11-14(13)16/h4-5,11,15H,3,6-10H2,1-2H3.
What are the key properties of N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine?
N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine is sourced from PubChem (CID 115105803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).