N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide

C18H20N4OS — CID 45206060

IUPACN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
SMILESCc1ccn2cc(CNC(=O)c3ccc(C4CCCN4)s3)nc2c1
InChIInChI=1S/C18H20N4OS/c1-12-6-8-22-11-13(21-17(22)9-12)10-20-18(23)16-5-4-15(24-16)14-3-2-7-19-14/h4-6,8-9,11,14,19H,2-3,7,10H2,1H3,(H,20,23)
InChIKeyKPLYHQDSHVJQBH-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.06
Rot. Bonds4

About N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide

N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide (PubChem CID 45206060) has the molecular formula C18H20N4OS and a molecular weight of 340.45 g/mol. Its IUPAC name is N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
PubChem CID45206060
Molecular FormulaC18H20N4OS
Molecular Weight340.45 g/mol
Exact Mass340.14
IUPAC NameN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
SMILESCc1ccn2cc(CNC(=O)c3ccc(C4CCCN4)s3)nc2c1
InChIInChI=1S/C18H20N4OS/c1-12-6-8-22-11-13(21-17(22)9-12)10-20-18(23)16-5-4-15(24-16)14-3-2-7-19-14/h4-6,8-9,11,14,19H,2-3,7,10H2,1H3,(H,20,23)
InChIKeyKPLYHQDSHVJQBH-UHFFFAOYSA-N
XLogP3.06
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45208476
2-chloro-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 154856521
N-(2-phenylethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45178110
N,N,4-trimethyl-2-[[5-[(2S)-pyrrolidin-2-yl]thiophene-2-carbonyl]amino]-1,3-thiazole-5-carboxamide
CID 31044771
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
CID 131901200
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]furan-2-carboxamide
CID 22517208
N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45189077
methyl 5-pyrrolidin-2-ylthiophene-2-carboxylate
CID 130001149
3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]butanamide
CID 47343605
2-methoxy-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 47343610
N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45185745
(3R)-1-cycloheptyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 42097141

Frequently Asked Questions

What is the IUPAC name of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The IUPAC name of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide (CID 45206060) is N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide.
What is the SMILES notation for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The canonical SMILES for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide is Cc1ccn2cc(CNC(=O)c3ccc(C4CCCN4)s3)nc2c1.
What is the InChIKey of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The InChIKey is KPLYHQDSHVJQBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4OS/c1-12-6-8-22-11-13(21-17(22)9-12)10-20-18(23)16-5-4-15(24-16)14-3-2-7-19-14/h4-6,8-9,11,14,19H,2-3,7,10H2,1H3,(H,20,23).
What are the key properties of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide?
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 45206060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).