5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine

C19H26N2 — CID 167468234

IUPAC5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine
SMILESC=C(C)Nc1c[nH]c2ccc(CCCC3CC3CC)cc12
InChIInChI=1S/C19H26N2/c1-4-15-11-16(15)7-5-6-14-8-9-18-17(10-14)19(12-20-18)21-13(2)3/h8-10,12,15-16,20-21H,2,4-7,11H2,1,3H3
InChIKeySOGRICZYZYPWJN-UHFFFAOYSA-N
MW282.43 g/mol
LogP5.48
Rot. Bonds7

About 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine

5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine (PubChem CID 167468234) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine.

Molecular Properties

Compound Name5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine
PubChem CID167468234
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine
SMILESC=C(C)Nc1c[nH]c2ccc(CCCC3CC3CC)cc12
InChIInChI=1S/C19H26N2/c1-4-15-11-16(15)7-5-6-14-8-9-18-17(10-14)19(12-20-18)21-13(2)3/h8-10,12,15-16,20-21H,2,4-7,11H2,1,3H3
InChIKeySOGRICZYZYPWJN-UHFFFAOYSA-N
XLogP5.48
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.43
LogP ≤ 55.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(3-ethylcyclobutyl)ethenyl]-5-[2-[4-(trifluoromethyl)phenyl]ethyl]-1H-indol-3-amine
CID 167467934
3-bromo-6-butyl-1H-quinolin-4-one
CID 114759349
trans-(1S,2S)-2-methyl-N-[5-[2-[4-(trifluoromethyl)phenoxy]ethyl]-1H-indol-3-yl]cyclopropane-1-carboxamide
CID 167467793
N-[5-[[4-(trifluoromethyl)phenyl]methyl]-1H-indol-3-yl]acetamide
CID 167468240
N-(5-bromo-1H-indol-3-yl)-4-(4,4,4-trifluorobutyl)benzamide
CID 162445144
N-[5-[2-(3-chloro-5-cyanophenoxy)ethyl]-1H-indol-3-yl]acetamide
CID 167467711
3-methyl-5-(3-piperazin-1-ylpropyl)-1H-indole
CID 116996532
N-[5-[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-1H-indol-3-yl]acetamide
CID 167467546
2-[3-(ethylamino)-1H-indol-5-yl]acetonitrile
CID 159146438
N-(2-bromo-4-butylphenyl)acetamide
CID 23274178
propane;N-prop-1-en-2-yl-1H-indol-4-amine
CID 143997760
4-(3-methyl-1H-indol-5-yl)butan-1-amine
CID 117291124

Frequently Asked Questions

What is the IUPAC name of 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine?
The IUPAC name of 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine (CID 167468234) is 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine.
What is the SMILES notation for 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine?
The canonical SMILES for 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine is C=C(C)Nc1c[nH]c2ccc(CCCC3CC3CC)cc12.
What is the InChIKey of 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine?
The InChIKey is SOGRICZYZYPWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-4-15-11-16(15)7-5-6-14-8-9-18-17(10-14)19(12-20-18)21-13(2)3/h8-10,12,15-16,20-21H,2,4-7,11H2,1,3H3.
What are the key properties of 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine?
5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine has a molecular weight of 282.43 g/mol, XLogP of 5.48, 7 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2-ethylcyclopropyl)propyl]-N-prop-1-en-2-yl-1H-indol-3-amine is sourced from PubChem (CID 167468234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).