N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride

C24H29Cl2N5O2S — CID 66787094

About N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride

N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride (PubChem CID 66787094) has the molecular formula C24H29Cl2N5O2S and a molecular weight of 522.50 g/mol. Its IUPAC name is N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride.

Molecular Properties

• Compound Name: N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride
• PubChem CID: 66787094
• Molecular Formula: C24H29Cl2N5O2S
• Molecular Weight: 522.50 g/mol
• Exact Mass: 521.14
• IUPAC Name: N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride
• SMILES: CC(C)N1CCc2nc(C(=O)NC3CCCC3(N)C(=O)c3cc4cc(Cl)ccc4[nH]3)sc2C1.Cl
• InChI: InChI=1S/C24H28ClN5O2S.ClH/c1-13(2)30-9-7-17-19(12-30)33-23(28-17)22(32)29-20-4-3-8-24(20,26)21(31)18-11-14-10-15(25)5-6-16(14)27-18;/h5-6,10-11,13,20,27H,3-4,7-9,12,26H2,1-2H3,(H,29,32);1H
• InChIKey: GNOTUILGLNOPRB-UHFFFAOYSA-N
• XLogP: 4.33
• TPSA: 104.11 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	522.50
LogP ≤ 5	4.33
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride?

The IUPAC name of N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride (CID 66787094) is N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride.

What is the SMILES notation for N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride?

The canonical SMILES for N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride is CC(C)N1CCc2nc(C(=O)NC3CCCC3(N)C(=O)c3cc4cc(Cl)ccc4[nH]3)sc2C1.Cl.

What is the InChIKey of N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride?

The InChIKey is GNOTUILGLNOPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28ClN5O2S.ClH/c1-13(2)30-9-7-17-19(12-30)33-23(28-17)22(32)29-20-4-3-8-24(20,26)21(31)18-11-14-10-15(25)5-6-16(14)27-18;/h5-6,10-11,13,20,27H,3-4,7-9,12,26H2,1-2H3,(H,29,32);1H.

What are the key properties of N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride?

N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride has a molecular weight of 522.50 g/mol, XLogP of 4.33, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-amino-2-(5-chloro-1H-indole-2-carbonyl)cyclopentyl]-5-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 66787094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).