3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride

C10H17Cl2N5O — CID 119509819

IUPAC3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride
SMILESCl.Cl.Nc1nccnc1C(=O)NCC1CCCN1
InChIInChI=1S/C10H15N5O.2ClH/c11-9-8(13-4-5-14-9)10(16)15-6-7-2-1-3-12-7;;/h4-5,7,12H,1-3,6H2,(H2,11,14)(H,15,16);2*1H
InChIKeyDOYPYYDMRKJVDA-UHFFFAOYSA-N
MW294.19 g/mol
LogP0.38
Rot. Bonds3

About 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride

3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride (PubChem CID 119509819) has the molecular formula C10H17Cl2N5O and a molecular weight of 294.19 g/mol. Its IUPAC name is 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound Name3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride
PubChem CID119509819
Molecular FormulaC10H17Cl2N5O
Molecular Weight294.19 g/mol
Exact Mass293.08
IUPAC Name3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride
SMILESCl.Cl.Nc1nccnc1C(=O)NCC1CCCN1
InChIInChI=1S/C10H15N5O.2ClH/c11-9-8(13-4-5-14-9)10(16)15-6-7-2-1-3-12-7;;/h4-5,7,12H,1-3,6H2,(H2,11,14)(H,15,16);2*1H
InChIKeyDOYPYYDMRKJVDA-UHFFFAOYSA-N
XLogP0.38
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.19
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(cyclobutylmethyl)pyrazine-2-carboxamide
CID 38654065
3-amino-N-[(2-hydroxycyclohexyl)methyl]pyrazine-2-carboxamide
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N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide
CID 83619395
2-methyl-N-(pyrrolidin-2-ylmethyl)-1,3-thiazole-5-carboxamide;hydrochloride
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5-bromo-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 119513668
3-amino-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]pyrazine-2-carboxamide
CID 94018036
2,2,2-trifluoro-N-(pyrrolidin-2-ylmethyl)acetamide;hydrochloride
CID 87470013
2-bromo-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119511017
2-methoxy-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 55126271
1-methyl-5-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrazole-3-carboxamide;hydrochloride
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4-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide;hydrochloride
CID 119510567

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride?
The IUPAC name of 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride (CID 119509819) is 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride.
What is the SMILES notation for 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride?
The canonical SMILES for 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride is Cl.Cl.Nc1nccnc1C(=O)NCC1CCCN1.
What is the InChIKey of 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride?
The InChIKey is DOYPYYDMRKJVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O.2ClH/c11-9-8(13-4-5-14-9)10(16)15-6-7-2-1-3-12-7;;/h4-5,7,12H,1-3,6H2,(H2,11,14)(H,15,16);2*1H.
What are the key properties of 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride?
3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride has a molecular weight of 294.19 g/mol, XLogP of 0.38, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(pyrrolidin-2-ylmethyl)pyrazine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119509819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).