2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide

C15H17N3OS — CID 119720410

IUPAC2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide
SMILESO=C(CNCC1CC1)Nc1ncc(-c2ccccc2)s1
InChIInChI=1S/C15H17N3OS/c19-14(10-16-8-11-6-7-11)18-15-17-9-13(20-15)12-4-2-1-3-5-12/h1-5,9,11,16H,6-8,10H2,(H,17,18,19)
InChIKeyYQQDXAUKSPCWCK-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.75
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide

2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide (PubChem CID 119720410) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide
PubChem CID119720410
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide
SMILESO=C(CNCC1CC1)Nc1ncc(-c2ccccc2)s1
InChIInChI=1S/C15H17N3OS/c19-14(10-16-8-11-6-7-11)18-15-17-9-13(20-15)12-4-2-1-3-5-12/h1-5,9,11,16H,6-8,10H2,(H,17,18,19)
InChIKeyYQQDXAUKSPCWCK-UHFFFAOYSA-N
XLogP2.75
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide (CID 119720410) is 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide is O=C(CNCC1CC1)Nc1ncc(-c2ccccc2)s1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is YQQDXAUKSPCWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c19-14(10-16-8-11-6-7-11)18-15-17-9-13(20-15)12-4-2-1-3-5-12/h1-5,9,11,16H,6-8,10H2,(H,17,18,19).
What are the key properties of 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide?
2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 287.39 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 119720410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).