N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride

C12H19ClN2OS — CID 71638238

IUPACN-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride
SMILESCc1ccsc1C(=O)NC1CCCCC1N.Cl
InChIInChI=1S/C12H18N2OS.ClH/c1-8-6-7-16-11(8)12(15)14-10-5-3-2-4-9(10)13;/h6-7,9-10H,2-5,13H2,1H3,(H,14,15);1H
InChIKeyGPVXMHFOCAYLMY-UHFFFAOYSA-N
MW274.82 g/mol
LogP2.48
Rot. Bonds2

About N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride

N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride (PubChem CID 71638238) has the molecular formula C12H19ClN2OS and a molecular weight of 274.82 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride
PubChem CID71638238
Molecular FormulaC12H19ClN2OS
Molecular Weight274.82 g/mol
Exact Mass274.09
IUPAC NameN-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride
SMILESCc1ccsc1C(=O)NC1CCCCC1N.Cl
InChIInChI=1S/C12H18N2OS.ClH/c1-8-6-7-16-11(8)12(15)14-10-5-3-2-4-9(10)13;/h6-7,9-10H,2-5,13H2,1H3,(H,14,15);1H
InChIKeyGPVXMHFOCAYLMY-UHFFFAOYSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.82
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(2-methylcyclohexyl)thiophene-2-carboxamide
CID 25162656
N-[2-(chloromethyl)cyclohexyl]-3-methylthiophene-2-carboxamide
CID 106366771
N-(2-aminocyclopentyl)-3-ethylthiophene-2-carboxamide
CID 63251494
cis-(1R,2S)-2-[(3-methylthiophene-2-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 97161349
3-methyl-N-[2-(piperidin-1-ylmethyl)cyclohexyl]thiophene-2-carboxamide
CID 140519163
N-(2-cyanocyclopentyl)-3-methylthiophene-2-carboxamide
CID 62963070
(2-aminocycloheptyl)-(3-methylthiophen-2-yl)methanone
CID 116595147
N-(2-aminocycloheptyl)-4-methylthiadiazole-5-carboxamide
CID 63258149
N-(2-aminocyclohexyl)-4-methylbenzamide
CID 61037352
3-methyl-N-[(2R,3R)-2-(4-methylphenyl)oxan-3-yl]thiophene-2-carboxamide
CID 95964683
trans-(1S,3S)-3-[(3-methylthiophene-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 97318295
N-[(1S,2R)-2-[4-(2-hydroxypropan-2-yl)triazol-1-yl]cyclohexyl]-3-methylthiophene-2-carboxamide
CID 128994036

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride (CID 71638238) is N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride is Cc1ccsc1C(=O)NC1CCCCC1N.Cl.
What is the InChIKey of N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride?
The InChIKey is GPVXMHFOCAYLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS.ClH/c1-8-6-7-16-11(8)12(15)14-10-5-3-2-4-9(10)13;/h6-7,9-10H,2-5,13H2,1H3,(H,14,15);1H.
What are the key properties of N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride?
N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride has a molecular weight of 274.82 g/mol, XLogP of 2.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-3-methylthiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 71638238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).