1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol

C9H15N3O — CID 62333203

IUPAC1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol
SMILESCC(O)CN(C)Cc1cnccn1
InChIInChI=1S/C9H15N3O/c1-8(13)6-12(2)7-9-5-10-3-4-11-9/h3-5,8,13H,6-7H2,1-2H3
InChIKeyLWBFTDDTXRTWMN-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.29
Rot. Bonds4

About 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol

1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol (PubChem CID 62333203) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol
PubChem CID62333203
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol
SMILESCC(O)CN(C)Cc1cnccn1
InChIInChI=1S/C9H15N3O/c1-8(13)6-12(2)7-9-5-10-3-4-11-9/h3-5,8,13H,6-7H2,1-2H3
InChIKeyLWBFTDDTXRTWMN-UHFFFAOYSA-N
XLogP0.29
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(pyrazin-2-ylmethyl)propan-2-amine
CID 70659288
N-methyl-1-(4-propan-2-ylphenyl)-N-(pyrazin-2-ylmethyl)methanamine
CID 74239331
1-methyl-1-(pyrazin-2-ylmethyl)hydrazine
CID 169495103
(2S)-2-(4-fluorophenyl)-2-hydroxy-N-methyl-N-(pyrazin-2-ylmethyl)acetamide
CID 99974191
3-[propan-2-yl(pyrazin-2-ylmethyl)amino]propan-1-ol
CID 62016590
(2S)-2-amino-N,4-dimethyl-N-(pyrazin-2-ylmethyl)pentanamide
CID 119867897
1-[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]amino]propan-2-ol
CID 62334490
N-methyl-5-propan-2-yl-N-(pyrazin-2-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 133433792
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-N-(pyrazin-2-ylmethyl)methanamine
CID 77083522
N-methyl-1-(2-phenylphenyl)-N-(pyrazin-2-ylmethyl)methanamine
CID 74243937
3-[methyl(pyrazin-2-ylmethyl)amino]-1-piperazin-1-ylpropan-1-one;dihydrochloride
CID 120982556
N,N,N',N'-tetrakis(pyrazin-2-ylmethyl)propane-1,3-diamine
CID 71362661

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol?
The IUPAC name of 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol (CID 62333203) is 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol.
What is the SMILES notation for 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol?
The canonical SMILES for 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol is CC(O)CN(C)Cc1cnccn1.
What is the InChIKey of 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol?
The InChIKey is LWBFTDDTXRTWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-8(13)6-12(2)7-9-5-10-3-4-11-9/h3-5,8,13H,6-7H2,1-2H3.
What are the key properties of 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol?
1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol has a molecular weight of 181.24 g/mol, XLogP of 0.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(pyrazin-2-ylmethyl)amino]propan-2-ol is sourced from PubChem (CID 62333203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).