5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide

C19H14ClN3OS — CID 90570305

IUPAC5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide
SMILESO=C(c1ccc(Cl)s1)N(Cc1cnc2ccccn12)c1ccccc1
InChIInChI=1S/C19H14ClN3OS/c20-17-10-9-16(25-17)19(24)23(14-6-2-1-3-7-14)13-15-12-21-18-8-4-5-11-22(15)18/h1-12H,13H2
InChIKeyIKJMAMHJZYJOEJ-UHFFFAOYSA-N
MW367.86 g/mol
LogP4.90
Rot. Bonds4

About 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide

5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide (PubChem CID 90570305) has the molecular formula C19H14ClN3OS and a molecular weight of 367.86 g/mol. Its IUPAC name is 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide
PubChem CID90570305
Molecular FormulaC19H14ClN3OS
Molecular Weight367.86 g/mol
Exact Mass367.05
IUPAC Name5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide
SMILESO=C(c1ccc(Cl)s1)N(Cc1cnc2ccccn12)c1ccccc1
InChIInChI=1S/C19H14ClN3OS/c20-17-10-9-16(25-17)19(24)23(14-6-2-1-3-7-14)13-15-12-21-18-8-4-5-11-22(15)18/h1-12H,13H2
InChIKeyIKJMAMHJZYJOEJ-UHFFFAOYSA-N
XLogP4.90
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.86
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide (CID 90570305) is 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide is O=C(c1ccc(Cl)s1)N(Cc1cnc2ccccn12)c1ccccc1.
What is the InChIKey of 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide?
The InChIKey is IKJMAMHJZYJOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3OS/c20-17-10-9-16(25-17)19(24)23(14-6-2-1-3-7-14)13-15-12-21-18-8-4-5-11-22(15)18/h1-12H,13H2.
What are the key properties of 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide?
5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide has a molecular weight of 367.86 g/mol, XLogP of 4.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylthiophene-2-carboxamide is sourced from PubChem (CID 90570305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).