3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine

C10H18N4 — CID 106331964

IUPAC3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine
SMILESCCC(C)(CC)Nc1nccnc1N
InChIInChI=1S/C10H18N4/c1-4-10(3,5-2)14-9-8(11)12-6-7-13-9/h6-7H,4-5H2,1-3H3,(H2,11,12)(H,13,14)
InChIKeyWGOIDFUHFCADNK-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.05
Rot. Bonds4

About 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine

3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine (PubChem CID 106331964) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine
PubChem CID106331964
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine
SMILESCCC(C)(CC)Nc1nccnc1N
InChIInChI=1S/C10H18N4/c1-4-10(3,5-2)14-9-8(11)12-6-7-13-9/h6-7H,4-5H2,1-3H3,(H2,11,12)(H,13,14)
InChIKeyWGOIDFUHFCADNK-UHFFFAOYSA-N
XLogP2.05
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-(3-methylpentan-3-ylamino)pyridine-4-carboxylic acid
CID 106331142
3-bromo-4-methyl-N-(3-methylpentan-3-yl)pyridin-2-amine
CID 106329769
3-methyl-2-N-(3-methylpentan-3-yl)pyridine-2,5-diamine
CID 106328101
3-N-(2-methylbutyl)pyrazine-2,3-diamine
CID 102984244
2-(3-methylpentan-3-ylamino)pyridine-3-carbonitrile
CID 106328911
3-N-[(4-ethylphenyl)methyl]pyrazine-2,3-diamine
CID 103634007
N-(3-methylpentan-3-yl)pyrazin-2-amine
CID 106329836
3-N-but-2-ynylpyrazine-2,3-diamine
CID 102987241
4-methyl-2-(3-methylpentan-3-ylamino)pyridine-3-carbonitrile
CID 106328949
3-(3-methylpentan-3-ylamino)-1-propan-2-ylpyrazin-2-one
CID 114174313
(2S)-2-[(3-aminopyrazin-2-yl)amino]butan-1-ol
CID 131154572
2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106329795

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine?
The IUPAC name of 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine (CID 106331964) is 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine?
The canonical SMILES for 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine is CCC(C)(CC)Nc1nccnc1N.
What is the InChIKey of 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine?
The InChIKey is WGOIDFUHFCADNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-4-10(3,5-2)14-9-8(11)12-6-7-13-9/h6-7H,4-5H2,1-3H3,(H2,11,12)(H,13,14).
What are the key properties of 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine?
3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine has a molecular weight of 194.28 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-methylpentan-3-yl)pyrazine-2,3-diamine is sourced from PubChem (CID 106331964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).