2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

C15H15N5OS — CID 110446261

IUPAC2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(CNc1ncnc2ccccc12)NCCc1nccs1
InChIInChI=1S/C15H15N5OS/c21-13(16-6-5-14-17-7-8-22-14)9-18-15-11-3-1-2-4-12(11)19-10-20-15/h1-4,7-8,10H,5-6,9H2,(H,16,21)(H,18,19,20)
InChIKeyBWFOPSBHQBMEHU-UHFFFAOYSA-N
MW313.39 g/mol
LogP1.86
Rot. Bonds6

About 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 110446261) has the molecular formula C15H15N5OS and a molecular weight of 313.39 g/mol. Its IUPAC name is 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID110446261
Molecular FormulaC15H15N5OS
Molecular Weight313.39 g/mol
Exact Mass313.10
IUPAC Name2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(CNc1ncnc2ccccc12)NCCc1nccs1
InChIInChI=1S/C15H15N5OS/c21-13(16-6-5-14-17-7-8-22-14)9-18-15-11-3-1-2-4-12(11)19-10-20-15/h1-4,7-8,10H,5-6,9H2,(H,16,21)(H,18,19,20)
InChIKeyBWFOPSBHQBMEHU-UHFFFAOYSA-N
XLogP1.86
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.39
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-propyl-2-(quinazolin-4-ylamino)acetamide
CID 39165546
2-[[2-(quinazolin-4-ylamino)acetyl]amino]acetic acid
CID 21002376
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-3-(quinazolin-4-ylamino)propanamide
CID 110436119
N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide
CID 49226597
N-(pyridin-3-ylmethyl)-2-(quinazolin-4-ylamino)acetamide
CID 110436040
2-(benzenesulfonamido)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110446219
2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110445560
N-(4-tert-butylphenyl)-2-(quinazolin-4-ylamino)acetamide
CID 110437164
N-(pyridin-2-ylmethyl)-4-(quinazolin-4-ylamino)butanamide
CID 110436147
1-benzyl-3-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 49470436
N-(2-methoxyethyl)-2-(thieno[2,3-d]pyrimidin-4-ylamino)acetamide
CID 9453782
N-(2-bromoprop-2-enyl)quinazolin-4-amine
CID 115594968

Frequently Asked Questions

What is the IUPAC name of 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (CID 110446261) is 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is O=C(CNc1ncnc2ccccc12)NCCc1nccs1.
What is the InChIKey of 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is BWFOPSBHQBMEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5OS/c21-13(16-6-5-14-17-7-8-22-14)9-18-15-11-3-1-2-4-12(11)19-10-20-15/h1-4,7-8,10H,5-6,9H2,(H,16,21)(H,18,19,20).
What are the key properties of 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 313.39 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 110446261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).