1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine

C17H25N3 — CID 103975700

IUPAC1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine
SMILESCCn1cc(CN2CCC(C(C)N)C2)c2ccccc21
InChIInChI=1S/C17H25N3/c1-3-20-12-15(16-6-4-5-7-17(16)20)11-19-9-8-14(10-19)13(2)18/h4-7,12-14H,3,8-11,18H2,1-2H3
InChIKeyLIZBSKAXHBTHEN-UHFFFAOYSA-N
MW271.41 g/mol
LogP2.83
Rot. Bonds4

About 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine

1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine (PubChem CID 103975700) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine.

Molecular Properties

Compound Name1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine
PubChem CID103975700
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine
SMILESCCn1cc(CN2CCC(C(C)N)C2)c2ccccc21
InChIInChI=1S/C17H25N3/c1-3-20-12-15(16-6-4-5-7-17(16)20)11-19-9-8-14(10-19)13(2)18/h4-7,12-14H,3,8-11,18H2,1-2H3
InChIKeyLIZBSKAXHBTHEN-UHFFFAOYSA-N
XLogP2.83
TPSA34.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[(1-ethylindol-3-yl)methyl]piperidin-4-yl]ethanamine
CID 63596895
[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]methanamine
CID 62068055
1-[1-[(1-methylindol-3-yl)methyl]piperidin-4-yl]ethanamine
CID 63597240
1-[1-(naphthalen-1-ylmethyl)pyrrolidin-3-yl]ethanamine
CID 112630234
1-ethyl-3-[(3-methylpiperazin-1-yl)methyl]indole
CID 65418728
1-[1-[(1-ethylindol-3-yl)methyl]piperidin-3-yl]-N-methylmethanamine
CID 61203945
1-[1-[[2-(methoxymethyl)phenyl]methyl]pyrrolidin-3-yl]ethanamine
CID 103975618
(1S)-1-[(3S)-1-benzylpyrrolidin-3-yl]ethanamine;dihydrochloride
CID 71741811
[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115311556
1-(1-ethylindol-3-yl)propan-2-amine
CID 6484661
1-[1-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidin-3-yl]ethanamine
CID 103975773
1-[1-[(2,3-dimethylphenyl)methyl]pyrrolidin-3-yl]ethanamine
CID 103975682

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine?
The IUPAC name of 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine (CID 103975700) is 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine.
What is the SMILES notation for 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine?
The canonical SMILES for 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine is CCn1cc(CN2CCC(C(C)N)C2)c2ccccc21.
What is the InChIKey of 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine?
The InChIKey is LIZBSKAXHBTHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-3-20-12-15(16-6-4-5-7-17(16)20)11-19-9-8-14(10-19)13(2)18/h4-7,12-14H,3,8-11,18H2,1-2H3.
What are the key properties of 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine?
1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine has a molecular weight of 271.41 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(1-ethylindol-3-yl)methyl]pyrrolidin-3-yl]ethanamine is sourced from PubChem (CID 103975700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).