N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride

C10H15ClN6OS — CID 119995821

IUPACN-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride
SMILESCC(CN)CNC(=O)c1sccc1-n1cnnn1.Cl
InChIInChI=1S/C10H14N6OS.ClH/c1-7(4-11)5-12-10(17)9-8(2-3-18-9)16-6-13-14-15-16;/h2-3,6-7H,4-5,11H2,1H3,(H,12,17);1H
InChIKeyWHRCFTCSNFQBPF-UHFFFAOYSA-N
MW302.79 g/mol
LogP0.47
Rot. Bonds5

About N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride

N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride (PubChem CID 119995821) has the molecular formula C10H15ClN6OS and a molecular weight of 302.79 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride
PubChem CID119995821
Molecular FormulaC10H15ClN6OS
Molecular Weight302.79 g/mol
Exact Mass302.07
IUPAC NameN-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride
SMILESCC(CN)CNC(=O)c1sccc1-n1cnnn1.Cl
InChIInChI=1S/C10H14N6OS.ClH/c1-7(4-11)5-12-10(17)9-8(2-3-18-9)16-6-13-14-15-16;/h2-3,6-7H,4-5,11H2,1H3,(H,12,17);1H
InChIKeyWHRCFTCSNFQBPF-UHFFFAOYSA-N
XLogP0.47
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.79
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-hydroxy-2-methylbutyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 66108564
3-(tetrazol-1-yl)-N-(3,3,3-trifluoro-2-hydroxypropyl)thiophene-2-carboxamide
CID 103730655
N-(2,3-dihydroxypropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 66177071
N-(5-hydroxy-4-methylpentyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 103862134
methyl 2-[[3-(tetrazol-1-yl)thiophene-2-carbonyl]amino]acetate
CID 43623271
N-(1-aminohexan-2-yl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride
CID 119668151
N,N-dimethyl-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 47323771
3-methyl-2-[[3-(tetrazol-1-yl)thiophene-2-carbonyl]amino]pentanoic acid
CID 43356470
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-(tetrazol-1-yl)thiophene-2-carboxamide
CID 103839754
3-(tetrazol-1-yl)-N-[1-(1,3,5-trimethylpyrazol-4-yl)ethyl]thiophene-2-carboxamide
CID 75370933
3-(tetrazol-1-yl)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]thiophene-2-carboxamide
CID 103716375
3-(tetrazol-1-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)thiophene-2-carboxamide
CID 120813693

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride (CID 119995821) is N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride is CC(CN)CNC(=O)c1sccc1-n1cnnn1.Cl.
What is the InChIKey of N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is WHRCFTCSNFQBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6OS.ClH/c1-7(4-11)5-12-10(17)9-8(2-3-18-9)16-6-13-14-15-16;/h2-3,6-7H,4-5,11H2,1H3,(H,12,17);1H.
What are the key properties of N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride?
N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 302.79 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-3-(tetrazol-1-yl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119995821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).