2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide

C10H15N3OS — CID 174641579

IUPAC2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1cnc(NCC2CCCC2)s1
InChIInChI=1S/C10H15N3OS/c11-9(14)8-6-13-10(15-8)12-5-7-3-1-2-4-7/h6-7H,1-5H2,(H2,11,14)(H,12,13)
InChIKeyQBBNTWCBRGUNLW-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.84
Rot. Bonds4

About 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide

2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide (PubChem CID 174641579) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide
PubChem CID174641579
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1cnc(NCC2CCCC2)s1
InChIInChI=1S/C10H15N3OS/c11-9(14)8-6-13-10(15-8)12-5-7-3-1-2-4-7/h6-7H,1-5H2,(H2,11,14)(H,12,13)
InChIKeyQBBNTWCBRGUNLW-UHFFFAOYSA-N
XLogP1.84
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide (CID 174641579) is 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide is NC(=O)c1cnc(NCC2CCCC2)s1.
What is the InChIKey of 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide?
The InChIKey is QBBNTWCBRGUNLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c11-9(14)8-6-13-10(15-8)12-5-7-3-1-2-4-7/h6-7H,1-5H2,(H2,11,14)(H,12,13).
What are the key properties of 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide?
2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethylamino)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 174641579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).