5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine

C10H17N3 — CID 61166078

IUPAC5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine
SMILESCC(C)(C)CNc1ccc(N)nc1
InChIInChI=1S/C10H17N3/c1-10(2,3)7-13-8-4-5-9(11)12-6-8/h4-6,13H,7H2,1-3H3,(H2,11,12)
InChIKeyMPJAHZDRVQZRPX-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.12
Rot. Bonds2

About 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine

5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine (PubChem CID 61166078) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine
PubChem CID61166078
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine
SMILESCC(C)(C)CNc1ccc(N)nc1
InChIInChI=1S/C10H17N3/c1-10(2,3)7-13-8-4-5-9(11)12-6-8/h4-6,13H,7H2,1-3H3,(H2,11,12)
InChIKeyMPJAHZDRVQZRPX-UHFFFAOYSA-N
XLogP2.12
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
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

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5-N-(2,2-dimethylpropyl)-2-N,2-N-dimethylpyridine-2,5-diamine
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CID 63004274
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5-N-(7-methyloctyl)pyridine-2,5-diamine
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Frequently Asked Questions

What is the IUPAC name of 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine?
The IUPAC name of 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine (CID 61166078) is 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine.
What is the SMILES notation for 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine?
The canonical SMILES for 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine is CC(C)(C)CNc1ccc(N)nc1.
What is the InChIKey of 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine?
The InChIKey is MPJAHZDRVQZRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-10(2,3)7-13-8-4-5-9(11)12-6-8/h4-6,13H,7H2,1-3H3,(H2,11,12).
What are the key properties of 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine?
5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine has a molecular weight of 179.27 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine is sourced from PubChem (CID 61166078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).