N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine

C17H27N3 — CID 174414194

IUPACN-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine
SMILESCCN1CCC(C(C)Nc2ccc3c(c2)NCC3)CC1
InChIInChI=1S/C17H27N3/c1-3-20-10-7-14(8-11-20)13(2)19-16-5-4-15-6-9-18-17(15)12-16/h4-5,12-14,18-19H,3,6-11H2,1-2H3
InChIKeyREFTZAUHGKTZBA-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.19
Rot. Bonds4

About N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine

N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine (PubChem CID 174414194) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine.

Molecular Properties

Compound NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine
PubChem CID174414194
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine
SMILESCCN1CCC(C(C)Nc2ccc3c(c2)NCC3)CC1
InChIInChI=1S/C17H27N3/c1-3-20-10-7-14(8-11-20)13(2)19-16-5-4-15-6-9-18-17(15)12-16/h4-5,12-14,18-19H,3,6-11H2,1-2H3
InChIKeyREFTZAUHGKTZBA-UHFFFAOYSA-N
XLogP3.19
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-ethylpiperidin-4-yl)ethyl]-3,5-difluoroaniline
CID 43308012
3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol
CID 43308530
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-(trifluoromethyl)aniline
CID 43307549
N-butan-2-yl-1,2,3,4-tetrahydroquinolin-7-amine
CID 79676970
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-fluoro-4-methoxyaniline
CID 43380417
4-chloro-N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methoxyaniline
CID 107620997
4-bromo-N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methoxyaniline
CID 82857817
N-[2,3-dihydro-1H-indol-6-yl-(1-ethylpiperidin-4-yl)methyl]acetamide;fluorobenzene
CID 174392016
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methylsulfanylaniline
CID 43307452
5-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-fluorobenzonitrile
CID 62316616
N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine
CID 43534725
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline
CID 43307344

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine?
The IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine (CID 174414194) is N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine.
What is the SMILES notation for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine?
The canonical SMILES for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine is CCN1CCC(C(C)Nc2ccc3c(c2)NCC3)CC1.
What is the InChIKey of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine?
The InChIKey is REFTZAUHGKTZBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-3-20-10-7-14(8-11-20)13(2)19-16-5-4-15-6-9-18-17(15)12-16/h4-5,12-14,18-19H,3,6-11H2,1-2H3.
What are the key properties of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine?
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine has a molecular weight of 273.42 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,3-dihydro-1H-indol-6-amine is sourced from PubChem (CID 174414194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).