3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride

C11H19Cl2N5O — CID 119474422

IUPAC3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride
SMILESCl.Cl.Nc1nccnc1C(=O)NC1CCC(N)CC1
InChIInChI=1S/C11H17N5O.2ClH/c12-7-1-3-8(4-2-7)16-11(17)9-10(13)15-6-5-14-9;;/h5-8H,1-4,12H2,(H2,13,15)(H,16,17);2*1H
InChIKeyTTXIBTDJRCABNE-UHFFFAOYSA-N
MW308.21 g/mol
LogP0.90
Rot. Bonds2

About 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride

3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride (PubChem CID 119474422) has the molecular formula C11H19Cl2N5O and a molecular weight of 308.21 g/mol. Its IUPAC name is 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound Name3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride
PubChem CID119474422
Molecular FormulaC11H19Cl2N5O
Molecular Weight308.21 g/mol
Exact Mass307.10
IUPAC Name3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride
SMILESCl.Cl.Nc1nccnc1C(=O)NC1CCC(N)CC1
InChIInChI=1S/C11H17N5O.2ClH/c12-7-1-3-8(4-2-7)16-11(17)9-10(13)15-6-5-14-9;;/h5-8H,1-4,12H2,(H2,13,15)(H,16,17);2*1H
InChIKeyTTXIBTDJRCABNE-UHFFFAOYSA-N
XLogP0.90
TPSA106.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride 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

3-amino-N-(1-methylpiperidin-4-yl)pyrazine-2-carboxamide
CID 47293314
cis-(1R,3S)-3-[(3-aminopyrazine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120678525
3-amino-N-(1-ethylpiperidin-4-yl)pyrazine-2-carboxamide
CID 30768284
2-N-(4-aminocyclohexyl)-3-N-(4-chlorophenyl)pyrazine-2,3-dicarboxamide
CID 119478351
3-amino-N-(cyclobutylmethyl)pyrazine-2-carboxamide
CID 38654065
3-amino-N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]pyrazine-2-carboxamide;formic acid
CID 10267750
bis(3-aminopyrazin-2-yl)methanone
CID 155673522
N-(4-aminocyclohexyl)pyridazine-4-carboxamide
CID 104670019
3-amino-N-[(3S)-3,4-dihydro-2H-chromen-3-yl]pyrazine-2-carboxamide
CID 94066552
3-amino-N-(3,4-dihydro-2H-chromen-3-yl)pyrazine-2-carboxamide
CID 102556079
4-N-(4-aminocyclohexyl)benzene-1,4-dicarboxamide;hydrochloride
CID 119478160
3-amino-N-[(3R)-1-(2-oxo-1H-pyrazin-3-yl)piperidin-3-yl]pyrazine-2-carboxamide
CID 129476469

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride?
The IUPAC name of 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride (CID 119474422) is 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride.
What is the SMILES notation for 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride?
The canonical SMILES for 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride is Cl.Cl.Nc1nccnc1C(=O)NC1CCC(N)CC1.
What is the InChIKey of 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride?
The InChIKey is TTXIBTDJRCABNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O.2ClH/c12-7-1-3-8(4-2-7)16-11(17)9-10(13)15-6-5-14-9;;/h5-8H,1-4,12H2,(H2,13,15)(H,16,17);2*1H.
What are the key properties of 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride?
3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride has a molecular weight of 308.21 g/mol, XLogP of 0.90, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119474422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).