3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine

C12H21N3 — CID 104532814

IUPAC3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine
SMILESCCCN(c1cncc(NC)c1)C(C)C
InChIInChI=1S/C12H21N3/c1-5-6-15(10(2)3)12-7-11(13-4)8-14-9-12/h7-10,13H,5-6H2,1-4H3
InChIKeyQLPUHSNQFDDXEE-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.75
Rot. Bonds5

About 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine

3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine (PubChem CID 104532814) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine.

Molecular Properties

Compound Name3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine
PubChem CID104532814
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine
SMILESCCCN(c1cncc(NC)c1)C(C)C
InChIInChI=1S/C12H21N3/c1-5-6-15(10(2)3)12-7-11(13-4)8-14-9-12/h7-10,13H,5-6H2,1-4H3
InChIKeyQLPUHSNQFDDXEE-UHFFFAOYSA-N
XLogP2.75
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-N-methyl-5-N,5-N-dipropylpyridine-3,5-diamine
CID 104532476
5-bromo-N-propan-2-yl-N-propylpyridin-3-amine
CID 104531552
5-N-(2-methoxyethyl)-5-N-(1-methoxypropan-2-yl)-3-N-methylpyridine-3,5-diamine
CID 104533784
5-N-(2-methoxyethyl)-5-N-propan-2-yl-3-N-propylpyridine-3,5-diamine
CID 113424214
3-[propan-2-yl-[5-(propylamino)-3-pyridinyl]amino]propan-1-ol
CID 113423873
5-N-butan-2-yl-5-N-butyl-3-N-ethylpyridine-3,5-diamine
CID 113423883
2-[2-hydroxyethyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104533210
5-N-methyl-5-N-(4-methylpentan-2-yl)-3-N-propylpyridine-3,5-diamine
CID 104533765
5-ethyl-N-methylpyridin-3-amine
CID 121404012
5-(methylaminomethyl)-N-propan-2-yl-N-propylpyrazin-2-amine
CID 107379107
5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine
CID 113423780
3-N,5-N,5-N-tripropylpyridine-3,5-diamine
CID 104532474

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine?
The IUPAC name of 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine (CID 104532814) is 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine.
What is the SMILES notation for 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine?
The canonical SMILES for 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine is CCCN(c1cncc(NC)c1)C(C)C.
What is the InChIKey of 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine?
The InChIKey is QLPUHSNQFDDXEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-5-6-15(10(2)3)12-7-11(13-4)8-14-9-12/h7-10,13H,5-6H2,1-4H3.
What are the key properties of 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine?
3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine has a molecular weight of 207.32 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methyl-5-N-propan-2-yl-5-N-propylpyridine-3,5-diamine is sourced from PubChem (CID 104532814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).