1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine

C11H19N3 — CID 116904567

IUPAC1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine
SMILESCN(C)C(c1ccccn1)C(C)(C)N
InChIInChI=1S/C11H19N3/c1-11(2,12)10(14(3)4)9-7-5-6-8-13-9/h5-8,10H,12H2,1-4H3
InChIKeyQABLPLXJXGHYCB-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.42
Rot. Bonds3

About 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine

1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine (PubChem CID 116904567) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine
PubChem CID116904567
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine
SMILESCN(C)C(c1ccccn1)C(C)(C)N
InChIInChI=1S/C11H19N3/c1-11(2,12)10(14(3)4)9-7-5-6-8-13-9/h5-8,10H,12H2,1-4H3
InChIKeyQABLPLXJXGHYCB-UHFFFAOYSA-N
XLogP1.42
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine?
The IUPAC name of 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine (CID 116904567) is 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine.
What is the SMILES notation for 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine?
The canonical SMILES for 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine is CN(C)C(c1ccccn1)C(C)(C)N.
What is the InChIKey of 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine?
The InChIKey is QABLPLXJXGHYCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-11(2,12)10(14(3)4)9-7-5-6-8-13-9/h5-8,10H,12H2,1-4H3.
What are the key properties of 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine?
1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine has a molecular weight of 193.29 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,2-trimethyl-1-pyridin-2-ylpropane-1,2-diamine is sourced from PubChem (CID 116904567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).