2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol

C10H16ClN3O — CID 104553306

IUPAC2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol
SMILESCc1nc(Cl)c(N(C)C(C)CO)nc1C
InChIInChI=1S/C10H16ClN3O/c1-6(5-15)14(4)10-9(11)12-7(2)8(3)13-10/h6,15H,5H2,1-4H3
InChIKeyDXPMACZYJBFOBJ-UHFFFAOYSA-N
MW229.71 g/mol
LogP1.56
Rot. Bonds3

About 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol

2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol (PubChem CID 104553306) has the molecular formula C10H16ClN3O and a molecular weight of 229.71 g/mol. Its IUPAC name is 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol.

Molecular Properties

Compound Name2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol
PubChem CID104553306
Molecular FormulaC10H16ClN3O
Molecular Weight229.71 g/mol
Exact Mass229.10
IUPAC Name2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol
SMILESCc1nc(Cl)c(N(C)C(C)CO)nc1C
InChIInChI=1S/C10H16ClN3O/c1-6(5-15)14(4)10-9(11)12-7(2)8(3)13-10/h6,15H,5H2,1-4H3
InChIKeyDXPMACZYJBFOBJ-UHFFFAOYSA-N
XLogP1.56
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol 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

2-[(6-chloro-2,5-dimethylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104553285
3-chloro-N,5,6-trimethyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazin-2-amine
CID 79488274
2-chloro-4-[[(2S)-1-hydroxypropan-2-yl]-methylamino]pyrimidin-5-ol
CID 126590832
3-chloro-N-ethyl-5,6-dimethyl-N-(2-methylbutyl)pyrazin-2-amine
CID 79470519
2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]-methylamino]propan-1-ol
CID 102759773
4-chloro-6-[1-hydroxypropan-2-yl(methyl)amino]pyrimidine-5-carbaldehyde
CID 104552441
3-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]-N,2-dimethylpropanamide
CID 106917523
2-[(6-amino-5-methyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 113426551
N'-hydroxy-3-[1-hydroxypropan-2-yl(methyl)amino]-5,6-dimethylpyridazine-4-carboximidamide
CID 136951845
2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104557168
2-[(3-bromo-4-methyl-2-pyridinyl)-methylamino]propan-1-ol
CID 106876368
2-[1-hydroxypropan-2-yl(methyl)amino]-4,6-dimethylpyridine-3-carbothioamide
CID 113426031

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol?
The IUPAC name of 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol (CID 104553306) is 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol.
What is the SMILES notation for 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol?
The canonical SMILES for 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol is Cc1nc(Cl)c(N(C)C(C)CO)nc1C.
What is the InChIKey of 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol?
The InChIKey is DXPMACZYJBFOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3O/c1-6(5-15)14(4)10-9(11)12-7(2)8(3)13-10/h6,15H,5H2,1-4H3.
What are the key properties of 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol?
2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol has a molecular weight of 229.71 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chloro-5,6-dimethylpyrazin-2-yl)-methylamino]propan-1-ol is sourced from PubChem (CID 104553306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).