3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine

C14H24N4O — CID 133475804

IUPAC3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine
SMILESCN(C)c1nccnc1NCCCC1CCCCO1
InChIInChI=1S/C14H24N4O/c1-18(2)14-13(16-9-10-17-14)15-8-5-7-12-6-3-4-11-19-12/h9-10,12H,3-8,11H2,1-2H3,(H,15,16)
InChIKeyDAZFJOMKYPHKAE-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.30
Rot. Bonds6

About 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine

3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine (PubChem CID 133475804) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine
PubChem CID133475804
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine
SMILESCN(C)c1nccnc1NCCCC1CCCCO1
InChIInChI=1S/C14H24N4O/c1-18(2)14-13(16-9-10-17-14)15-8-5-7-12-6-3-4-11-19-12/h9-10,12H,3-8,11H2,1-2H3,(H,15,16)
InChIKeyDAZFJOMKYPHKAE-UHFFFAOYSA-N
XLogP2.30
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine with MolForge

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Related Compounds

2-[3-(oxan-2-yl)propylamino]pyridine-4-carbonitrile
CID 136542339
2-N,2-N-dimethyl-3-N-(oxolan-2-ylmethyl)pyridine-2,3-diamine
CID 82834810
2-[3-(oxan-2-yl)propyl]oxane
CID 71182925
2-methyl-N-[2-(oxan-2-yl)ethyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104925300
3-[[methyl(oxan-2-ylmethyl)amino]methyl]-N-propylpyridin-2-amine
CID 62469581
3-amino-2-[2-(oxan-2-yl)ethylamino]pyridine-4-carbonitrile
CID 114135773
1-methyl-3-[2-(oxolan-2-yl)ethylamino]pyrazin-2-one
CID 62938870
N-[2-(oxan-2-yl)ethyl]-5,6,7,8-tetrahydroquinazolin-4-amine
CID 103990755
6-[3-[(2R)-oxan-2-yl]propylamino]pyridine-2-carbonitrile
CID 124618528
3,5-difluoro-N-[3-(oxolan-2-yl)propyl]aniline
CID 65163282
2-(3-chloropropyl)oxane
CID 23511686
N-[4-(oxolan-2-yl)butyl]-5-propan-2-ylpyrimidin-2-amine
CID 131907958

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine?
The IUPAC name of 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine (CID 133475804) is 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine is CN(C)c1nccnc1NCCCC1CCCCO1.
What is the InChIKey of 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine?
The InChIKey is DAZFJOMKYPHKAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-18(2)14-13(16-9-10-17-14)15-8-5-7-12-6-3-4-11-19-12/h9-10,12H,3-8,11H2,1-2H3,(H,15,16).
What are the key properties of 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine?
3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine has a molecular weight of 264.37 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-2-N-[3-(oxan-2-yl)propyl]pyrazine-2,3-diamine is sourced from PubChem (CID 133475804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).