2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride

C20H32Cl2N4O2 — CID 119864723

IUPAC2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride
SMILESCCCC(C)(N)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1.Cl.Cl
InChIInChI=1S/C20H30N4O2.2ClH/c1-3-7-20(2,21)19(25)22-17-4-5-18-16(15-17)6-8-24(18)10-9-23-11-13-26-14-12-23;;/h4-6,8,15H,3,7,9-14,21H2,1-2H3,(H,22,25);2*1H
InChIKeyDPHUWSXQIDMXPI-UHFFFAOYSA-N
MW431.41 g/mol
LogP3.27
Rot. Bonds7

About 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride

2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride (PubChem CID 119864723) has the molecular formula C20H32Cl2N4O2 and a molecular weight of 431.41 g/mol. Its IUPAC name is 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride
PubChem CID119864723
Molecular FormulaC20H32Cl2N4O2
Molecular Weight431.41 g/mol
Exact Mass430.19
IUPAC Name2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride
SMILESCCCC(C)(N)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1.Cl.Cl
InChIInChI=1S/C20H30N4O2.2ClH/c1-3-7-20(2,21)19(25)22-17-4-5-18-16(15-17)6-8-24(18)10-9-23-11-13-26-14-12-23;;/h4-6,8,15H,3,7,9-14,21H2,1-2H3,(H,22,25);2*1H
InChIKeyDPHUWSXQIDMXPI-UHFFFAOYSA-N
XLogP3.27
TPSA72.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.41
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]butanamide;dihydrochloride
CID 120503366
1-hexyl-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56557196
4-[(2-amino-2-methylpentanoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 119865137
N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrrolidine-2-carboxamide
CID 119864704
1-[(4-chlorophenyl)methyl]-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56549716
N-[1-(2-morpholin-4-ylethyl)indol-5-yl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 49498023
1-[1-(2-morpholin-4-ylethyl)indol-5-yl]-3-(2-morpholin-4-ylpropyl)urea
CID 56556947
4-acetyl-3,5-dimethyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]-1H-pyrrole-2-carboxamide
CID 49498040
(2R)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]oxolane-2-carboxamide
CID 94391676
2-amino-2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pentanamide
CID 119712509
4-(cyclopropanecarbonyl)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]piperazine-1-carboxamide
CID 56556621
2-amino-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2-methylpentanamide;hydrochloride
CID 119677515

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride?
The IUPAC name of 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride (CID 119864723) is 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride is CCCC(C)(N)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1.Cl.Cl.
What is the InChIKey of 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride?
The InChIKey is DPHUWSXQIDMXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2.2ClH/c1-3-7-20(2,21)19(25)22-17-4-5-18-16(15-17)6-8-24(18)10-9-23-11-13-26-14-12-23;;/h4-6,8,15H,3,7,9-14,21H2,1-2H3,(H,22,25);2*1H.
What are the key properties of 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride?
2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride has a molecular weight of 431.41 g/mol, XLogP of 3.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pentanamide;dihydrochloride is sourced from PubChem (CID 119864723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).