5-methyl-2,3-dihydropyridine-3,6-diamine

C6H11N3 — CID 91145889

IUPAC5-methyl-2,3-dihydropyridine-3,6-diamine
SMILESCC1=CC(N)CN=C1N
InChIInChI=1S/C6H11N3/c1-4-2-5(7)3-9-6(4)8/h2,5H,3,7H2,1H3,(H2,8,9)
InChIKeyDUQXRQQXTFXBPT-UHFFFAOYSA-N
MW125.17 g/mol
LogP-0.37
Rot. Bonds

About 5-methyl-2,3-dihydropyridine-3,6-diamine

5-methyl-2,3-dihydropyridine-3,6-diamine (PubChem CID 91145889) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 5-methyl-2,3-dihydropyridine-3,6-diamine.

Molecular Properties

Compound Name5-methyl-2,3-dihydropyridine-3,6-diamine
PubChem CID91145889
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name5-methyl-2,3-dihydropyridine-3,6-diamine
SMILESCC1=CC(N)CN=C1N
InChIInChI=1S/C6H11N3/c1-4-2-5(7)3-9-6(4)8/h2,5H,3,7H2,1H3,(H2,8,9)
InChIKeyDUQXRQQXTFXBPT-UHFFFAOYSA-N
XLogP-0.37
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methyl-1,2,5,6-tetrahydropyridine-2-imine
CID 9793827
2-Pyridinamine, 3,6-dihydro-4-methyl-
CID 44313256
4,6-Dimethyl-5,6-dihydro-1H-pyridin-(2Z)-ylideneamine
CID 44313550
(Z)-N'-(3-aminobutan-2-yl)-2-ethylbut-2-enimidamide
CID 90944521
(E)-N-(aminomethylidene)-2-methyl-N'-propan-2-ylhex-2-enimidamide
CID 118973170
3,5-Dimethyl-2,3-dihydropyridin-6-amine
CID 123590083
(3S)-5-(trideuteriomethyl)-2,3-dihydropyridin-3-amine
CID 130298993
2-Methyl-2,5-dihydropyridin-6-amine
CID 141873465
5-Methyl-2,3-dihydropyridin-6-amine
CID 144380992
N',6-dimethyl-1,2,3,6-tetrahydropyridine-4-carboximidamide
CID 166075917
5-(1-Aminoethyl)-2,3-dihydropyridin-6-amine
CID 177180063
2-Pyridinamine, 3,6-dihydro-5-methyl-
CID 45116663

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3-dihydropyridine-3,6-diamine?
The IUPAC name of 5-methyl-2,3-dihydropyridine-3,6-diamine (CID 91145889) is 5-methyl-2,3-dihydropyridine-3,6-diamine.
What is the SMILES notation for 5-methyl-2,3-dihydropyridine-3,6-diamine?
The canonical SMILES for 5-methyl-2,3-dihydropyridine-3,6-diamine is CC1=CC(N)CN=C1N.
What is the InChIKey of 5-methyl-2,3-dihydropyridine-3,6-diamine?
The InChIKey is DUQXRQQXTFXBPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-4-2-5(7)3-9-6(4)8/h2,5H,3,7H2,1H3,(H2,8,9).
What are the key properties of 5-methyl-2,3-dihydropyridine-3,6-diamine?
5-methyl-2,3-dihydropyridine-3,6-diamine has a molecular weight of 125.17 g/mol, XLogP of -0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3-dihydropyridine-3,6-diamine is sourced from PubChem (CID 91145889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).