3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole

C15H18N2 — CID 14090369

IUPAC3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole
SMILESC1=CN(CCc2c[nH]c3ccccc23)CCC1
InChIInChI=1S/C15H18N2/c1-4-9-17(10-5-1)11-8-13-12-16-15-7-3-2-6-14(13)15/h2-4,6-7,9,12,16H,1,5,8,10-11H2
InChIKeyYMZMCWYFLJMPAX-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.32
Rot. Bonds3

About 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole

3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole (PubChem CID 14090369) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole.

Molecular Properties

Compound Name3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole
PubChem CID14090369
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole
SMILESC1=CN(CCc2c[nH]c3ccccc23)CCC1
InChIInChI=1S/C15H18N2/c1-4-9-17(10-5-1)11-8-13-12-16-15-7-3-2-6-14(13)15/h2-4,6-7,9,12,16H,1,5,8,10-11H2
InChIKeyYMZMCWYFLJMPAX-UHFFFAOYSA-N
XLogP3.32
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-pyrrolidin-1-ylethyl)-1H-indole
CID 26393
3-(2,2-dideuterio-2-pyrrolidin-1-ylethyl)-1H-indole
CID 166106987
3-[4-(1H-indol-3-yl)butyl]-1H-indole
CID 57060044
4-[2-(1H-indol-3-yl)ethyl]-1,4-thiazinane 1,1-dioxide
CID 2767993
4-[2-(1H-indol-3-yl)ethyl]piperazine-1-carbaldehyde
CID 91084591
3-[2-(4,4-difluoropiperidin-1-yl)ethyl]-1H-indole
CID 117007752
3-(1H-indol-3-yl)propane-1,1-diol
CID 22219738
1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol
CID 3054781
1-[2-(1H-indol-3-yl)ethyl]pyrrolidine-2-carbonitrile
CID 171079929
2-(1H-indol-3-yl)-1-[4-[2-(1H-indol-3-yl)ethyl]piperazin-1-yl]ethanone
CID 110412445
3-(4-piperazin-1-ylbutyl)-1H-indole
CID 95465204
8-(1H-indol-3-yl)octan-1-amine
CID 57188115

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole?
The IUPAC name of 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole (CID 14090369) is 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole.
What is the SMILES notation for 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole?
The canonical SMILES for 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole is C1=CN(CCc2c[nH]c3ccccc23)CCC1.
What is the InChIKey of 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole?
The InChIKey is YMZMCWYFLJMPAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-4-9-17(10-5-1)11-8-13-12-16-15-7-3-2-6-14(13)15/h2-4,6-7,9,12,16H,1,5,8,10-11H2.
What are the key properties of 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole?
3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole has a molecular weight of 226.32 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3,4-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole is sourced from PubChem (CID 14090369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).