6-N-(3-methylbutyl)pyridine-2,6-diamine

C10H17N3 — CID 80647498

IUPAC6-N-(3-methylbutyl)pyridine-2,6-diamine
SMILESCC(C)CCNc1cccc(N)n1
InChIInChI=1S/C10H17N3/c1-8(2)6-7-12-10-5-3-4-9(11)13-10/h3-5,8H,6-7H2,1-2H3,(H3,11,12,13)
InChIKeyZVZKNYQASOVPKO-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.12
Rot. Bonds4

About 6-N-(3-methylbutyl)pyridine-2,6-diamine

6-N-(3-methylbutyl)pyridine-2,6-diamine (PubChem CID 80647498) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 6-N-(3-methylbutyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(3-methylbutyl)pyridine-2,6-diamine
PubChem CID80647498
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name6-N-(3-methylbutyl)pyridine-2,6-diamine
SMILESCC(C)CCNc1cccc(N)n1
InChIInChI=1S/C10H17N3/c1-8(2)6-7-12-10-5-3-4-9(11)13-10/h3-5,8H,6-7H2,1-2H3,(H3,11,12,13)
InChIKeyZVZKNYQASOVPKO-UHFFFAOYSA-N
XLogP2.12
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(7-methyloctyl)pyridine-2,6-diamine
CID 114004472
6-hydrazinyl-N-(3-methylbutyl)pyridin-2-amine
CID 80931651
6-N-[2-(methylamino)ethyl]pyridine-2,6-diamine
CID 10888283
6-N-[2-[methyl(propan-2-yl)amino]ethyl]pyridine-2,6-diamine
CID 80646824
2-[(6-amino-2-pyridinyl)amino]ethanol
CID 66907238
6-N-(3-methoxypropyl)pyridine-2,6-diamine
CID 80647839
6-N-[2-(diethylamino)ethyl]pyridine-2,6-diamine
CID 10856706
4-[(6-amino-2-pyridinyl)amino]butan-1-ol
CID 106846869
2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide
CID 106343060
6-N-[2-(3-methylphenyl)ethyl]pyridine-2,6-diamine
CID 80647053
6-N-(2-cyclopentyloxyethyl)pyridine-2,6-diamine
CID 80647858
6-N-[(E)-but-2-enyl]pyridine-2,6-diamine
CID 131240121

Frequently Asked Questions

What is the IUPAC name of 6-N-(3-methylbutyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(3-methylbutyl)pyridine-2,6-diamine (CID 80647498) is 6-N-(3-methylbutyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(3-methylbutyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(3-methylbutyl)pyridine-2,6-diamine is CC(C)CCNc1cccc(N)n1.
What is the InChIKey of 6-N-(3-methylbutyl)pyridine-2,6-diamine?
The InChIKey is ZVZKNYQASOVPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8(2)6-7-12-10-5-3-4-9(11)13-10/h3-5,8H,6-7H2,1-2H3,(H3,11,12,13).
What are the key properties of 6-N-(3-methylbutyl)pyridine-2,6-diamine?
6-N-(3-methylbutyl)pyridine-2,6-diamine has a molecular weight of 179.27 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(3-methylbutyl)pyridine-2,6-diamine is sourced from PubChem (CID 80647498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).