2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide

C14H14N4O3S — CID 73333976

IUPAC2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide
SMILESCOc1nc(-c2ccnc(NC(=O)C3CC3)c2)sc1C(N)=O
InChIInChI=1S/C14H14N4O3S/c1-21-13-10(11(15)19)22-14(18-13)8-4-5-16-9(6-8)17-12(20)7-2-3-7/h4-7H,2-3H2,1H3,(H2,15,19)(H,16,17,20)
InChIKeyCYADPSMQNARVII-UHFFFAOYSA-N
MW318.36 g/mol
LogP1.66
Rot. Bonds5

About 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide

2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide (PubChem CID 73333976) has the molecular formula C14H14N4O3S and a molecular weight of 318.36 g/mol. Its IUPAC name is 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide
PubChem CID73333976
Molecular FormulaC14H14N4O3S
Molecular Weight318.36 g/mol
Exact Mass318.08
IUPAC Name2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide
SMILESCOc1nc(-c2ccnc(NC(=O)C3CC3)c2)sc1C(N)=O
InChIInChI=1S/C14H14N4O3S/c1-21-13-10(11(15)19)22-14(18-13)8-4-5-16-9(6-8)17-12(20)7-2-3-7/h4-7H,2-3H2,1H3,(H2,15,19)(H,16,17,20)
InChIKeyCYADPSMQNARVII-UHFFFAOYSA-N
XLogP1.66
TPSA107.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide (CID 73333976) is 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide is COc1nc(-c2ccnc(NC(=O)C3CC3)c2)sc1C(N)=O.
What is the InChIKey of 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide?
The InChIKey is CYADPSMQNARVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O3S/c1-21-13-10(11(15)19)22-14(18-13)8-4-5-16-9(6-8)17-12(20)7-2-3-7/h4-7H,2-3H2,1H3,(H2,15,19)(H,16,17,20).
What are the key properties of 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide?
2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide has a molecular weight of 318.36 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopropanecarbonylamino)-4-pyridinyl]-4-methoxy-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 73333976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).