1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine

C13H23N3 — CID 79053905

IUPAC1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine
SMILESCNC(c1cnccc1C)C(C)(C)N(C)C
InChIInChI=1S/C13H23N3/c1-10-7-8-15-9-11(10)12(14-4)13(2,3)16(5)6/h7-9,12,14H,1-6H3
InChIKeyHCMMCBCZFKKXDT-UHFFFAOYSA-N
MW221.35 g/mol
LogP1.99
Rot. Bonds4

About 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine

1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine (PubChem CID 79053905) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine
PubChem CID79053905
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine
SMILESCNC(c1cnccc1C)C(C)(C)N(C)C
InChIInChI=1S/C13H23N3/c1-10-7-8-15-9-11(10)12(14-4)13(2,3)16(5)6/h7-9,12,14H,1-6H3
InChIKeyHCMMCBCZFKKXDT-UHFFFAOYSA-N
XLogP1.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine (CID 79053905) is 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine is CNC(c1cnccc1C)C(C)(C)N(C)C.
What is the InChIKey of 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine?
The InChIKey is HCMMCBCZFKKXDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-10-7-8-15-9-11(10)12(14-4)13(2,3)16(5)6/h7-9,12,14H,1-6H3.
What are the key properties of 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine?
1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine has a molecular weight of 221.35 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine is sourced from PubChem (CID 79053905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).