N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride

C8H15ClN4OS — CID 120651512

IUPACN-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)c1cnns1.Cl
InChIInChI=1S/C8H14N4OS.ClH/c1-3-9-6(2)4-10-8(13)7-5-11-12-14-7;/h5-6,9H,3-4H2,1-2H3,(H,10,13);1H/t6-;/m1./s1
InChIKeyATDZVYBXGKYZFY-FYZOBXCZSA-N
MW250.75 g/mol
LogP0.69
Rot. Bonds5

About N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride

N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride (PubChem CID 120651512) has the molecular formula C8H15ClN4OS and a molecular weight of 250.75 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride
PubChem CID120651512
Molecular FormulaC8H15ClN4OS
Molecular Weight250.75 g/mol
Exact Mass250.07
IUPAC NameN-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)c1cnns1.Cl
InChIInChI=1S/C8H14N4OS.ClH/c1-3-9-6(2)4-10-8(13)7-5-11-12-14-7;/h5-6,9H,3-4H2,1-2H3,(H,10,13);1H/t6-;/m1./s1
InChIKeyATDZVYBXGKYZFY-FYZOBXCZSA-N
XLogP0.69
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.75
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methyl-2-propan-2-ylbutyl)thiadiazole-5-carboxamide
CID 102914845
N-(2-aminobutyl)thiadiazole-5-carboxamide
CID 63733239
N-(2-bromo-4-methylpentyl)thiadiazole-5-carboxamide
CID 107157654
N-[(2R)-2-(ethylamino)propyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 120650729
N-[2-(propan-2-ylamino)ethyl]thiadiazole-5-carboxamide
CID 62664375
N-[(2R)-2-(ethylamino)propyl]-5-methylthiophene-2-carboxamide;hydrochloride
CID 120653284
N-[2-(2-chloroethyl)pentyl]thiadiazole-5-carboxamide
CID 106117656
5-methyl-3-[(thiadiazole-5-carbonylamino)methyl]hexanoic acid
CID 65493699
N-(1-hydroxypropan-2-yl)thiadiazole-5-carboxamide
CID 43522681
5-bromo-N-[(2R)-2-(ethylamino)propyl]pyridine-3-carboxamide;dihydrochloride
CID 120653060
N-[(2R)-2-(ethylamino)propyl]-4-methylthiophene-3-carboxamide;hydrochloride
CID 120651296
3,5-dichloro-N-[(2R)-2-(ethylamino)propyl]benzamide;hydrochloride
CID 120654646

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride (CID 120651512) is N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride is CCN[C@H](C)CNC(=O)c1cnns1.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride?
The InChIKey is ATDZVYBXGKYZFY-FYZOBXCZSA-N. The full InChI is InChI=1S/C8H14N4OS.ClH/c1-3-9-6(2)4-10-8(13)7-5-11-12-14-7;/h5-6,9H,3-4H2,1-2H3,(H,10,13);1H/t6-;/m1./s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride?
N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride has a molecular weight of 250.75 g/mol, XLogP of 0.69, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]thiadiazole-5-carboxamide;hydrochloride is sourced from PubChem (CID 120651512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).