2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide

C15H19N3OS — CID 95136799

IUPAC2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide
SMILESCc1cn2c(n1)CC[C@@H](NC(=O)c1cc(C)sc1C)C2
InChIInChI=1S/C15H19N3OS/c1-9-7-18-8-12(4-5-14(18)16-9)17-15(19)13-6-10(2)20-11(13)3/h6-7,12H,4-5,8H2,1-3H3,(H,17,19)/t12-/m1/s1
InChIKeyCRMFCNHYMPYCNC-GFCCVEGCSA-N
MW289.40 g/mol
LogP2.61
Rot. Bonds2

About 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide

2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide (PubChem CID 95136799) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide
PubChem CID95136799
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide
SMILESCc1cn2c(n1)CC[C@@H](NC(=O)c1cc(C)sc1C)C2
InChIInChI=1S/C15H19N3OS/c1-9-7-18-8-12(4-5-14(18)16-9)17-15(19)13-6-10(2)20-11(13)3/h6-7,12H,4-5,8H2,1-3H3,(H,17,19)/t12-/m1/s1
InChIKeyCRMFCNHYMPYCNC-GFCCVEGCSA-N
XLogP2.61
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide (CID 95136799) is 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide is Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc(C)sc1C)C2.
What is the InChIKey of 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide?
The InChIKey is CRMFCNHYMPYCNC-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-9-7-18-8-12(4-5-14(18)16-9)17-15(19)13-6-10(2)20-11(13)3/h6-7,12H,4-5,8H2,1-3H3,(H,17,19)/t12-/m1/s1.
What are the key properties of 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide?
2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide has a molecular weight of 289.40 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide is sourced from PubChem (CID 95136799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).