2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride

C15H25Cl2N3O — CID 119868382

IUPAC2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride
SMILESCC1Cc2ccccc2N1CCNC(=O)C(C)(C)N.Cl.Cl
InChIInChI=1S/C15H23N3O.2ClH/c1-11-10-12-6-4-5-7-13(12)18(11)9-8-17-14(19)15(2,3)16;;/h4-7,11H,8-10,16H2,1-3H3,(H,17,19);2*1H
InChIKeyLSGQHJLTBXVFHJ-UHFFFAOYSA-N
MW334.29 g/mol
LogP2.13
Rot. Bonds4

About 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride

2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride (PubChem CID 119868382) has the molecular formula C15H25Cl2N3O and a molecular weight of 334.29 g/mol. Its IUPAC name is 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride
PubChem CID119868382
Molecular FormulaC15H25Cl2N3O
Molecular Weight334.29 g/mol
Exact Mass333.14
IUPAC Name2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride
SMILESCC1Cc2ccccc2N1CCNC(=O)C(C)(C)N.Cl.Cl
InChIInChI=1S/C15H23N3O.2ClH/c1-11-10-12-6-4-5-7-13(12)18(11)9-8-17-14(19)15(2,3)16;;/h4-7,11H,8-10,16H2,1-3H3,(H,17,19);2*1H
InChIKeyLSGQHJLTBXVFHJ-UHFFFAOYSA-N
XLogP2.13
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.29
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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4-(2-methyl-2,3-dihydroindol-1-yl)butanamide
CID 82040812
1-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]-2-(2-methylpropyl)guanidine
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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride?
The IUPAC name of 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride (CID 119868382) is 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride is CC1Cc2ccccc2N1CCNC(=O)C(C)(C)N.Cl.Cl.
What is the InChIKey of 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride?
The InChIKey is LSGQHJLTBXVFHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O.2ClH/c1-11-10-12-6-4-5-7-13(12)18(11)9-8-17-14(19)15(2,3)16;;/h4-7,11H,8-10,16H2,1-3H3,(H,17,19);2*1H.
What are the key properties of 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride?
2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride has a molecular weight of 334.29 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]propanamide;dihydrochloride is sourced from PubChem (CID 119868382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).