3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine

C14H26N6 — CID 105261374

IUPAC3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(C(NN)C2CN(C)CCCN2C)c1
InChIInChI=1S/C14H26N6/c1-10-7-11(14(15)17-8-10)13(18-16)12-9-19(2)5-4-6-20(12)3/h7-8,12-13,18H,4-6,9,16H2,1-3H3,(H2,15,17)
InChIKeyMPOZNJDBOSOTCG-UHFFFAOYSA-N
MW278.40 g/mol
LogP0.11
Rot. Bonds3

About 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine

3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine (PubChem CID 105261374) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine
PubChem CID105261374
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC Name3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(C(NN)C2CN(C)CCCN2C)c1
InChIInChI=1S/C14H26N6/c1-10-7-11(14(15)17-8-10)13(18-16)12-9-19(2)5-4-6-20(12)3/h7-8,12-13,18H,4-6,9,16H2,1-3H3,(H2,15,17)
InChIKeyMPOZNJDBOSOTCG-UHFFFAOYSA-N
XLogP0.11
TPSA83.44 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(1,4-dimethyl-1,4-diazepan-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105261347
[(1,4-dimethyl-1,4-diazepan-2-yl)-pyrimidin-5-ylmethyl]hydrazine
CID 105261200
3-[cyclooctyl(hydrazinyl)methyl]-5-methylpyridin-2-amine
CID 105255255
3-[hydrazinyl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-5-methylpyridin-2-amine
CID 105265905
[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105261259
[(4-bromothiophen-3-yl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261189
[(5-bromo-2-fluorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261300
[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105261282
[(1,4-dimethyl-1,4-diazepan-2-yl)-(4-fluorophenyl)methyl]hydrazine
CID 105261273
[(4-chlorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261246
(2-amino-5-methyl-3-pyridinyl)-(4-methylthiomorpholin-3-yl)methanol
CID 103595651
1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol
CID 115414904

Frequently Asked Questions

What is the IUPAC name of 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine?
The IUPAC name of 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine (CID 105261374) is 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine.
What is the SMILES notation for 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine?
The canonical SMILES for 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine is Cc1cnc(N)c(C(NN)C2CN(C)CCCN2C)c1.
What is the InChIKey of 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine?
The InChIKey is MPOZNJDBOSOTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-10-7-11(14(15)17-8-10)13(18-16)12-9-19(2)5-4-6-20(12)3/h7-8,12-13,18H,4-6,9,16H2,1-3H3,(H2,15,17).
What are the key properties of 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine?
3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine has a molecular weight of 278.40 g/mol, XLogP of 0.11, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine is sourced from PubChem (CID 105261374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).