5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one

C15H23N3O — CID 115204017

IUPAC5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one
SMILESCC(N)CCCN1C(=O)Cc2cc(CCN)ccc21
InChIInChI=1S/C15H23N3O/c1-11(17)3-2-8-18-14-5-4-12(6-7-16)9-13(14)10-15(18)19/h4-5,9,11H,2-3,6-8,10,16-17H2,1H3
InChIKeyGONSFWLJYBBRGS-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.20
Rot. Bonds6

About 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one

5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one (PubChem CID 115204017) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one.

Molecular Properties

Compound Name5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one
PubChem CID115204017
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one
SMILESCC(N)CCCN1C(=O)Cc2cc(CCN)ccc21
InChIInChI=1S/C15H23N3O/c1-11(17)3-2-8-18-14-5-4-12(6-7-16)9-13(14)10-15(18)19/h4-5,9,11H,2-3,6-8,10,16-17H2,1H3
InChIKeyGONSFWLJYBBRGS-UHFFFAOYSA-N
XLogP1.20
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-aminoethyl)-1-(3-hydroxypropyl)-3H-indol-2-one
CID 115217029
1-(3-aminobutyl)-5-(aminomethyl)-3H-indol-2-one
CID 115199281
5-(2-aminoethyl)-1-ethyl-3H-indol-2-one
CID 82190443
5-(2-aminoethyl)-1-(aminomethyl)-3H-indol-2-one
CID 115226042
1-(5-aminohexyl)-3H-indol-2-one
CID 114993593
1-(3-aminobutanoyl)-5-(2-aminoethyl)-3H-indol-2-one
CID 115154334
5-(2-aminoethyl)-1-(2,2,2-trifluoroethyl)-3H-indol-2-one
CID 115258033
5-(aminomethyl)-1-[2-(propan-2-ylamino)ethyl]-3H-indol-2-one
CID 115206450
5-[2-(methylamino)ethyl]-1-(3-sulfanylpropyl)-3H-indol-2-one
CID 115225243
methyl 4-[5-(aminomethyl)-2-oxo-3H-indol-1-yl]butanoate
CID 115233425
5-[(3-aminobutylamino)methyl]-1-methyl-3H-indol-2-one
CID 115199282
5-(2-aminoethyl)-1-(3-aminopropanoyl)-3H-indol-2-one
CID 115152987

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one?
The IUPAC name of 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one (CID 115204017) is 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one.
What is the SMILES notation for 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one?
The canonical SMILES for 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one is CC(N)CCCN1C(=O)Cc2cc(CCN)ccc21.
What is the InChIKey of 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one?
The InChIKey is GONSFWLJYBBRGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(17)3-2-8-18-14-5-4-12(6-7-16)9-13(14)10-15(18)19/h4-5,9,11H,2-3,6-8,10,16-17H2,1H3.
What are the key properties of 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one?
5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one has a molecular weight of 261.37 g/mol, XLogP of 1.20, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-1-(4-aminopentyl)-3H-indol-2-one is sourced from PubChem (CID 115204017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).