N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine

C12H23N5O2 — CID 103060605

IUPACN-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine
SMILESCOCCCN(CCOC)Cc1cnc(NN)cn1
InChIInChI=1S/C12H23N5O2/c1-18-6-3-4-17(5-7-19-2)10-11-8-15-12(16-13)9-14-11/h8-9H,3-7,10,13H2,1-2H3,(H,15,16)
InChIKeyWTCVWIVPGFNITG-UHFFFAOYSA-N
MW269.35 g/mol
LogP0.25
Rot. Bonds10

About N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine

N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine (PubChem CID 103060605) has the molecular formula C12H23N5O2 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine.

Molecular Properties

Compound NameN-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine
PubChem CID103060605
Molecular FormulaC12H23N5O2
Molecular Weight269.35 g/mol
Exact Mass269.19
IUPAC NameN-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine
SMILESCOCCCN(CCOC)Cc1cnc(NN)cn1
InChIInChI=1S/C12H23N5O2/c1-18-6-3-4-17(5-7-19-2)10-11-8-15-12(16-13)9-14-11/h8-9H,3-7,10,13H2,1-2H3,(H,15,16)
InChIKeyWTCVWIVPGFNITG-UHFFFAOYSA-N
XLogP0.25
TPSA85.53 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[ethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]propan-1-ol
CID 103061212
[5-(3-methoxypropylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062099
2-[butyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]acetamide
CID 103060559
1-(5-hydrazinylpyrazin-2-yl)-N,N-dimethylmethanamine
CID 103060816
N'-[(5-hydrazinylpyrazin-2-yl)methyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 103061005
5-[(dibutylamino)methyl]-N-methylpyrazin-2-amine
CID 103055563
5-[[bis(2-ethoxyethyl)amino]methyl]-N-ethylpyrazin-2-amine
CID 103056772
N-[(5-chloropyrazin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
CID 103054155
6-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]-N-propylpyridin-2-amine
CID 79234138
N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine
CID 103060861
N-(cyclopropylmethyl)-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine
CID 103061017
2-[2,2-difluoroethyl-[(5-hydrazinylpyrazin-2-yl)methyl]amino]ethanol
CID 107486351

Frequently Asked Questions

What is the IUPAC name of N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine?
The IUPAC name of N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine (CID 103060605) is N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine.
What is the SMILES notation for N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine?
The canonical SMILES for N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine is COCCCN(CCOC)Cc1cnc(NN)cn1.
What is the InChIKey of N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine?
The InChIKey is WTCVWIVPGFNITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5O2/c1-18-6-3-4-17(5-7-19-2)10-11-8-15-12(16-13)9-14-11/h8-9H,3-7,10,13H2,1-2H3,(H,15,16).
What are the key properties of N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine?
N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine has a molecular weight of 269.35 g/mol, XLogP of 0.25, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-hydrazinylpyrazin-2-yl)methyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine is sourced from PubChem (CID 103060605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).