N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

C15H20N4OS — CID 119665216

IUPACN-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
SMILESCCCCC(CN)NC(=O)c1cnc(-c2ccncc2)s1
InChIInChI=1S/C15H20N4OS/c1-2-3-4-12(9-16)19-14(20)13-10-18-15(21-13)11-5-7-17-8-6-11/h5-8,10,12H,2-4,9,16H2,1H3,(H,19,20)
InChIKeyDRADWNQJPTXVKK-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.45
Rot. Bonds7

About N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide (PubChem CID 119665216) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
PubChem CID119665216
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC NameN-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
SMILESCCCCC(CN)NC(=O)c1cnc(-c2ccncc2)s1
InChIInChI=1S/C15H20N4OS/c1-2-3-4-12(9-16)19-14(20)13-10-18-15(21-13)11-5-7-17-8-6-11/h5-8,10,12H,2-4,9,16H2,1H3,(H,19,20)
InChIKeyDRADWNQJPTXVKK-UHFFFAOYSA-N
XLogP2.45
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-aminohexan-2-yl)-2-phenyl-1,3-thiazole-5-carboxamide
CID 119668466
N-(1-aminohexan-2-yl)-2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide
CID 119667279
N-(1-amino-4-methylpentan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119585732
N-[2-(ethylamino)ethyl]-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 119505049
N-(1-aminohexan-2-yl)-3-methylthiophene-2-carboxamide
CID 80697346
N-(1-aminohexan-2-yl)-1-benzothiophene-2-carboxamide;hydrochloride
CID 119665559
2-amino-N-(1-aminohexan-2-yl)benzamide
CID 122080973
N-(1-aminohexan-2-yl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide;dihydrochloride
CID 119665156
N-(1-aminohexan-2-yl)-4-(methylsulfamoyl)thiophene-2-carboxamide;hydrochloride
CID 119668329
N-(1-aminohexan-2-yl)-6-(trifluoromethyl)pyridine-3-carboxamide;dihydrochloride
CID 119667500
N-(1-aminohexan-2-yl)-4-methyl-2-(1-methylpyrazol-4-yl)-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119665731
2-(4-methoxyphenyl)-1,3-thiazole-5-carbohydrazide
CID 82424257

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide (CID 119665216) is N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide is CCCCC(CN)NC(=O)c1cnc(-c2ccncc2)s1.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The InChIKey is DRADWNQJPTXVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-2-3-4-12(9-16)19-14(20)13-10-18-15(21-13)11-5-7-17-8-6-11/h5-8,10,12H,2-4,9,16H2,1H3,(H,19,20).
What are the key properties of N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide has a molecular weight of 304.42 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 119665216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).