N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine

C19H24N4S — CID 74246051

IUPACN-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine
SMILESCN(Cc1ccc(CN2CCCC2)s1)Cc1cnc2ccccn12
InChIInChI=1S/C19H24N4S/c1-21(13-16-12-20-19-6-2-3-11-23(16)19)14-17-7-8-18(24-17)15-22-9-4-5-10-22/h2-3,6-8,11-12H,4-5,9-10,13-15H2,1H3
InChIKeyWNMBBWXYJXXAER-UHFFFAOYSA-N
MW340.50 g/mol
LogP3.62
Rot. Bonds6

About N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine

N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine (PubChem CID 74246051) has the molecular formula C19H24N4S and a molecular weight of 340.50 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine
PubChem CID74246051
Molecular FormulaC19H24N4S
Molecular Weight340.50 g/mol
Exact Mass340.17
IUPAC NameN-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine
SMILESCN(Cc1ccc(CN2CCCC2)s1)Cc1cnc2ccccn12
InChIInChI=1S/C19H24N4S/c1-21(13-16-12-20-19-6-2-3-11-23(16)19)14-17-7-8-18(24-17)15-22-9-4-5-10-22/h2-3,6-8,11-12H,4-5,9-10,13-15H2,1H3
InChIKeyWNMBBWXYJXXAER-UHFFFAOYSA-N
XLogP3.62
TPSA23.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.50
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine?
The IUPAC name of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine (CID 74246051) is N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine is CN(Cc1ccc(CN2CCCC2)s1)Cc1cnc2ccccn12.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine?
The InChIKey is WNMBBWXYJXXAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4S/c1-21(13-16-12-20-19-6-2-3-11-23(16)19)14-17-7-8-18(24-17)15-22-9-4-5-10-22/h2-3,6-8,11-12H,4-5,9-10,13-15H2,1H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine?
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine has a molecular weight of 340.50 g/mol, XLogP of 3.62, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-1-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methanamine is sourced from PubChem (CID 74246051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).