2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride

C16H24ClN3O — CID 119331199

IUPAC2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccc2ccn(CCC)c2c1.Cl
InChIInChI=1S/C16H23N3O.ClH/c1-3-5-14(17)16(20)18-13-7-6-12-8-10-19(9-4-2)15(12)11-13;/h6-8,10-11,14H,3-5,9,17H2,1-2H3,(H,18,20);1H
InChIKeyCORMMMBMTYCRDB-UHFFFAOYSA-N
MW309.84 g/mol
LogP3.54
Rot. Bonds6

About 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride

2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride (PubChem CID 119331199) has the molecular formula C16H24ClN3O and a molecular weight of 309.84 g/mol. Its IUPAC name is 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride
PubChem CID119331199
Molecular FormulaC16H24ClN3O
Molecular Weight309.84 g/mol
Exact Mass309.16
IUPAC Name2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1ccc2ccn(CCC)c2c1.Cl
InChIInChI=1S/C16H23N3O.ClH/c1-3-5-14(17)16(20)18-13-7-6-12-8-10-19(9-4-2)15(12)11-13;/h6-8,10-11,14H,3-5,9,17H2,1-2H3,(H,18,20);1H
InChIKeyCORMMMBMTYCRDB-UHFFFAOYSA-N
XLogP3.54
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-methylsulfonyl-N-(1-propylindol-6-yl)butanamide
CID 119957554
(2S)-2-amino-4-methylsulfanyl-N-(1-propylindol-5-yl)butanamide;dihydrochloride
CID 119865579
2-methyl-3-(methylamino)-N-(1-propylindol-6-yl)propanamide;hydrochloride
CID 119797080
2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide
CID 119331183
(2S)-2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-4-methylpentanamide;dihydrochloride
CID 119891314
2-amino-N-(1-ethylindazol-6-yl)pentanamide;hydrochloride
CID 119305696
2-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-3-phenylpropanamide;dihydrochloride
CID 119891246
4-amino-3-methoxy-N-(1-propylindol-6-yl)butanamide
CID 120592934
(2S)-2-amino-N-[1-[2-(methylamino)-2-oxoethyl]indol-6-yl]-4-methylsulfanylbutanamide
CID 119312283
1-(4-hydroxy-2-methylbutyl)-3-(1-propylindol-6-yl)urea
CID 111474973
3-methylsulfonyl-N-(1-propylindol-6-yl)propanamide
CID 71990600
(2S)-2-amino-4-methyl-N-[1-[2-(methylamino)-2-oxoethyl]indol-6-yl]pentanamide
CID 119764210

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride (CID 119331199) is 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride is CCCC(N)C(=O)Nc1ccc2ccn(CCC)c2c1.Cl.
What is the InChIKey of 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride?
The InChIKey is CORMMMBMTYCRDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O.ClH/c1-3-5-14(17)16(20)18-13-7-6-12-8-10-19(9-4-2)15(12)11-13;/h6-8,10-11,14H,3-5,9,17H2,1-2H3,(H,18,20);1H.
What are the key properties of 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride?
2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride has a molecular weight of 309.84 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride is sourced from PubChem (CID 119331199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).