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

C14H17N3OS — CID 95765636

IUPAC3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide
SMILESCCc1ccsc1C(=O)N[C@H]1CCc2nccn2C1
InChIInChI=1S/C14H17N3OS/c1-2-10-5-8-19-13(10)14(18)16-11-3-4-12-15-6-7-17(12)9-11/h5-8,11H,2-4,9H2,1H3,(H,16,18)/t11-/m0/s1
InChIKeyYXDMAOVMQKLPTF-NSHDSACASA-N
MW275.38 g/mol
LogP2.25
Rot. Bonds3

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

3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide (PubChem CID 95765636) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide
PubChem CID95765636
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide
SMILESCCc1ccsc1C(=O)N[C@H]1CCc2nccn2C1
InChIInChI=1S/C14H17N3OS/c1-2-10-5-8-19-13(10)14(18)16-11-3-4-12-15-6-7-17(12)9-11/h5-8,11H,2-4,9H2,1H3,(H,16,18)/t11-/m0/s1
InChIKeyYXDMAOVMQKLPTF-NSHDSACASA-N
XLogP2.25
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide?
The IUPAC name of 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide (CID 95765636) is 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide.
What is the SMILES notation for 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide?
The canonical SMILES for 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide is CCc1ccsc1C(=O)N[C@H]1CCc2nccn2C1.
What is the InChIKey of 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide?
The InChIKey is YXDMAOVMQKLPTF-NSHDSACASA-N. The full InChI is InChI=1S/C14H17N3OS/c1-2-10-5-8-19-13(10)14(18)16-11-3-4-12-15-6-7-17(12)9-11/h5-8,11H,2-4,9H2,1H3,(H,16,18)/t11-/m0/s1.
What are the key properties of 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide?
3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide has a molecular weight of 275.38 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-2-carboxamide is sourced from PubChem (CID 95765636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).