2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride

C15H17ClN4O2S — CID 119736222

IUPAC2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride
SMILESCC(NC(=O)c1csc(CN)n1)c1ccc2c(c1)CC(=O)N2.Cl
InChIInChI=1S/C15H16N4O2S.ClH/c1-8(17-15(21)12-7-22-14(6-16)19-12)9-2-3-11-10(4-9)5-13(20)18-11;/h2-4,7-8H,5-6,16H2,1H3,(H,17,21)(H,18,20);1H
InChIKeyMFSYPNYHNQJWOG-UHFFFAOYSA-N
MW352.85 g/mol
LogP2.01
Rot. Bonds4

About 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride

2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride (PubChem CID 119736222) has the molecular formula C15H17ClN4O2S and a molecular weight of 352.85 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride
PubChem CID119736222
Molecular FormulaC15H17ClN4O2S
Molecular Weight352.85 g/mol
Exact Mass352.08
IUPAC Name2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride
SMILESCC(NC(=O)c1csc(CN)n1)c1ccc2c(c1)CC(=O)N2.Cl
InChIInChI=1S/C15H16N4O2S.ClH/c1-8(17-15(21)12-7-22-14(6-16)19-12)9-2-3-11-10(4-9)5-13(20)18-11;/h2-4,7-8H,5-6,16H2,1H3,(H,17,21)(H,18,20);1H
InChIKeyMFSYPNYHNQJWOG-UHFFFAOYSA-N
XLogP2.01
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.85
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride with MolForge

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Related Compounds

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2-(aminomethyl)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-1,3-thiazole-4-carboxamide
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2-methyl-3-(methylamino)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propanamide
CID 119736221
5-nitro-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]thiophene-2-carboxamide
CID 71940657
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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride?
The IUPAC name of 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride (CID 119736222) is 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride?
The canonical SMILES for 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride is CC(NC(=O)c1csc(CN)n1)c1ccc2c(c1)CC(=O)N2.Cl.
What is the InChIKey of 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride?
The InChIKey is MFSYPNYHNQJWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2S.ClH/c1-8(17-15(21)12-7-22-14(6-16)19-12)9-2-3-11-10(4-9)5-13(20)18-11;/h2-4,7-8H,5-6,16H2,1H3,(H,17,21)(H,18,20);1H.
What are the key properties of 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride?
2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride has a molecular weight of 352.85 g/mol, XLogP of 2.01, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[1-(2-oxo-1,3-dihydroindol-5-yl)ethyl]-1,3-thiazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 119736222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).