5-N-(4-methylpentyl)pyridine-2,5-diamine

C11H19N3 — CID 63004274

IUPAC5-N-(4-methylpentyl)pyridine-2,5-diamine
SMILESCC(C)CCCNc1ccc(N)nc1
InChIInChI=1S/C11H19N3/c1-9(2)4-3-7-13-10-5-6-11(12)14-8-10/h5-6,8-9,13H,3-4,7H2,1-2H3,(H2,12,14)
InChIKeyZKQLNBGTQNEDAP-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.51
Rot. Bonds5

About 5-N-(4-methylpentyl)pyridine-2,5-diamine

5-N-(4-methylpentyl)pyridine-2,5-diamine (PubChem CID 63004274) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 5-N-(4-methylpentyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-(4-methylpentyl)pyridine-2,5-diamine
PubChem CID63004274
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name5-N-(4-methylpentyl)pyridine-2,5-diamine
SMILESCC(C)CCCNc1ccc(N)nc1
InChIInChI=1S/C11H19N3/c1-9(2)4-3-7-13-10-5-6-11(12)14-8-10/h5-6,8-9,13H,3-4,7H2,1-2H3,(H2,12,14)
InChIKeyZKQLNBGTQNEDAP-UHFFFAOYSA-N
XLogP2.51
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-N-(7-methyloctyl)pyridine-2,5-diamine
CID 107814726
4-N-(6-methylheptyl)benzene-1,4-diamine
CID 141141781
5-N-hexan-2-ylpyridine-2,5-diamine
CID 62198332
2-methyl-4-N-(4-methylpentyl)benzene-1,4-diamine
CID 63004629
4-N,4-N-dimethyl-1-N-(4-methylpentyl)benzene-1,4-diamine
CID 83155630
2-[(6-amino-3-pyridinyl)amino]propan-1-ol
CID 43498943
4-[(6-amino-3-pyridinyl)amino]butanoic acid
CID 117044632
5-[1-(3-methylbutylamino)ethyl]pyridin-2-amine
CID 69291107
4-(4-methylpentylamino)benzoic acid
CID 63003341
5-N-(2,2-dimethylpropyl)pyridine-2,5-diamine
CID 61166078
5-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-2,5-diamine
CID 62040677
3,4-difluoro-N-(4-methylpentyl)aniline
CID 83155387

Frequently Asked Questions

What is the IUPAC name of 5-N-(4-methylpentyl)pyridine-2,5-diamine?
The IUPAC name of 5-N-(4-methylpentyl)pyridine-2,5-diamine (CID 63004274) is 5-N-(4-methylpentyl)pyridine-2,5-diamine.
What is the SMILES notation for 5-N-(4-methylpentyl)pyridine-2,5-diamine?
The canonical SMILES for 5-N-(4-methylpentyl)pyridine-2,5-diamine is CC(C)CCCNc1ccc(N)nc1.
What is the InChIKey of 5-N-(4-methylpentyl)pyridine-2,5-diamine?
The InChIKey is ZKQLNBGTQNEDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-9(2)4-3-7-13-10-5-6-11(12)14-8-10/h5-6,8-9,13H,3-4,7H2,1-2H3,(H2,12,14).
What are the key properties of 5-N-(4-methylpentyl)pyridine-2,5-diamine?
5-N-(4-methylpentyl)pyridine-2,5-diamine has a molecular weight of 193.29 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(4-methylpentyl)pyridine-2,5-diamine is sourced from PubChem (CID 63004274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).