N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride

C11H19ClN4O — CID 71642976

IUPACN-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride
SMILESCOc1nccnc1CNCC1CCCN1.Cl
InChIInChI=1S/C11H18N4O.ClH/c1-16-11-10(14-5-6-15-11)8-12-7-9-3-2-4-13-9;/h5-6,9,12-13H,2-4,7-8H2,1H3;1H
InChIKeyXGKXPKSLQNVENJ-UHFFFAOYSA-N
MW258.75 g/mol
LogP0.75
Rot. Bonds5

About N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride

N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride (PubChem CID 71642976) has the molecular formula C11H19ClN4O and a molecular weight of 258.75 g/mol. Its IUPAC name is N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride.

Molecular Properties

Compound NameN-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride
PubChem CID71642976
Molecular FormulaC11H19ClN4O
Molecular Weight258.75 g/mol
Exact Mass258.12
IUPAC NameN-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride
SMILESCOc1nccnc1CNCC1CCCN1.Cl
InChIInChI=1S/C11H18N4O.ClH/c1-16-11-10(14-5-6-15-11)8-12-7-9-3-2-4-13-9;/h5-6,9,12-13H,2-4,7-8H2,1H3;1H
InChIKeyXGKXPKSLQNVENJ-UHFFFAOYSA-N
XLogP0.75
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;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-[(3-methylsulfanylpyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride
CID 71643444
2-methoxy-3-[[(2R)-pyrrolidin-2-yl]methoxymethyl]pyrazine
CID 97164864
N-[(3-chloropyrazin-2-yl)methyl]-1-[(2S)-piperidin-2-yl]methanamine
CID 97163969
2-methoxy-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 55126271
2-methoxy-3-(pyrrolidin-2-ylmethoxy)pyridine
CID 122208651
N-[(3-methoxypyrazin-2-yl)methyl]propan-2-amine
CID 66569579
N-[(4-fluorophenyl)methyl]-1-[(2S)-pyrrolidin-2-yl]methanamine
CID 86329810
N-[(4-fluorophenyl)methyl]-1-[(2R)-pyrrolidin-2-yl]methanamine
CID 86329812
N-[(2-methoxy-3,5-dimethylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
CID 115208267
N-[(2-methoxy-4,6-dimethylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
CID 115208286
tert-butyl (2S)-2-[[(3-methoxypyrazin-2-yl)methylamino]methyl]pyrrolidine-1-carboxylate
CID 97168287
N-[(4-ethoxyphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
CID 115208247

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride?
The IUPAC name of N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride (CID 71642976) is N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride.
What is the SMILES notation for N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride?
The canonical SMILES for N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride is COc1nccnc1CNCC1CCCN1.Cl.
What is the InChIKey of N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride?
The InChIKey is XGKXPKSLQNVENJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.ClH/c1-16-11-10(14-5-6-15-11)8-12-7-9-3-2-4-13-9;/h5-6,9,12-13H,2-4,7-8H2,1H3;1H.
What are the key properties of N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride?
N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxypyrazin-2-yl)methyl]-1-pyrrolidin-2-ylmethanamine;hydrochloride is sourced from PubChem (CID 71642976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).