N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine

C14H19N3S — CID 115685594

IUPACN-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine
SMILESCc1nc2ccccn2c1CNC1CCSCC1
InChIInChI=1S/C14H19N3S/c1-11-13(10-15-12-5-8-18-9-6-12)17-7-3-2-4-14(17)16-11/h2-4,7,12,15H,5-6,8-10H2,1H3
InChIKeyGFVYTGMJBTUZEC-UHFFFAOYSA-N
MW261.39 g/mol
LogP2.63
Rot. Bonds3

About N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine

N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine (PubChem CID 115685594) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine.

Molecular Properties

Compound NameN-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine
PubChem CID115685594
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC NameN-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine
SMILESCc1nc2ccccn2c1CNC1CCSCC1
InChIInChI=1S/C14H19N3S/c1-11-13(10-15-12-5-8-18-9-6-12)17-7-3-2-4-14(17)16-11/h2-4,7,12,15H,5-6,8-10H2,1H3
InChIKeyGFVYTGMJBTUZEC-UHFFFAOYSA-N
XLogP2.63
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]cyclohexanamine
CID 43755994
N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]cyclopropanamine
CID 43478365
2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]cyclopropan-1-amine
CID 62398309
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-thiomorpholin-4-ylethanamine
CID 103745424
3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]piperidin-2-one
CID 62092301
N-[(1-cyclopropylcyclopropyl)methyl]-1-(2-methylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 103838603
(2-methylimidazo[1,2-a]pyridin-3-yl)methylurea
CID 139728346
N-[[2-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]cyclopropanamine
CID 43478186
N-butan-2-yl-3-[(cyclopropylamino)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine
CID 43478455
2-fluoro-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43763308
2-ethyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43764503
3-[(cyclopropylamino)methyl]-N-propan-2-yl-N-propylimidazo[1,2-a]pyridin-2-amine
CID 43478425

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine?
The IUPAC name of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine (CID 115685594) is N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine.
What is the SMILES notation for N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine?
The canonical SMILES for N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine is Cc1nc2ccccn2c1CNC1CCSCC1.
What is the InChIKey of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine?
The InChIKey is GFVYTGMJBTUZEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-11-13(10-15-12-5-8-18-9-6-12)17-7-3-2-4-14(17)16-11/h2-4,7,12,15H,5-6,8-10H2,1H3.
What are the key properties of N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine?
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine has a molecular weight of 261.39 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]thian-4-amine is sourced from PubChem (CID 115685594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).