1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine

C15H17N3S — CID 65244077

IUPAC1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine
SMILESCc1cc(CNCc2cn3ccccc3n2)sc1C
InChIInChI=1S/C15H17N3S/c1-11-7-14(19-12(11)2)9-16-8-13-10-18-6-4-3-5-15(18)17-13/h3-7,10,16H,8-9H2,1-2H3
InChIKeyLZYKHVJNEPXJKX-UHFFFAOYSA-N
MW271.39 g/mol
LogP3.30
Rot. Bonds4

About 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine

1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine (PubChem CID 65244077) has the molecular formula C15H17N3S and a molecular weight of 271.39 g/mol. Its IUPAC name is 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine
PubChem CID65244077
Molecular FormulaC15H17N3S
Molecular Weight271.39 g/mol
Exact Mass271.11
IUPAC Name1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine
SMILESCc1cc(CNCc2cn3ccccc3n2)sc1C
InChIInChI=1S/C15H17N3S/c1-11-7-14(19-12(11)2)9-16-8-13-10-18-6-4-3-5-15(18)17-13/h3-7,10,16H,8-9H2,1-2H3
InChIKeyLZYKHVJNEPXJKX-UHFFFAOYSA-N
XLogP3.30
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(6-methyl-3-pyridinyl)methanamine
CID 62996570
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
CID 114505443
4-[(imidazo[1,2-a]pyridin-2-ylmethylamino)methyl]phenol
CID 115572847
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(oxolan-2-yl)methanamine
CID 43180162
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2,2-dimethoxyethanamine
CID 60687022
1-(2,5-difluorophenyl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine
CID 63030565
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 63000781
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropan-2-amine
CID 28586618
4-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)butan-1-amine
CID 106844928
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-methylsulfanylpropan-1-amine
CID 63964732
2,5-dichloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylaniline
CID 104726088
4-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylaniline
CID 55118825

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine?
The IUPAC name of 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine (CID 65244077) is 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine?
The canonical SMILES for 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine is Cc1cc(CNCc2cn3ccccc3n2)sc1C.
What is the InChIKey of 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine?
The InChIKey is LZYKHVJNEPXJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3S/c1-11-7-14(19-12(11)2)9-16-8-13-10-18-6-4-3-5-15(18)17-13/h3-7,10,16H,8-9H2,1-2H3.
What are the key properties of 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine?
1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine has a molecular weight of 271.39 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethylthiophen-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)methanamine is sourced from PubChem (CID 65244077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).