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

C10H17N3 — CID 116938957

IUPAC2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine
SMILESCNC(C)(C)C(N)c1ccccn1
InChIInChI=1S/C10H17N3/c1-10(2,12-3)9(11)8-6-4-5-7-13-8/h4-7,9,12H,11H2,1-3H3
InChIKeySEDOMTPTVFJOPB-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.08
Rot. Bonds3

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

2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine (PubChem CID 116938957) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine
PubChem CID116938957
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine
SMILESCNC(C)(C)C(N)c1ccccn1
InChIInChI=1S/C10H17N3/c1-10(2,12-3)9(11)8-6-4-5-7-13-8/h4-7,9,12H,11H2,1-3H3
InChIKeySEDOMTPTVFJOPB-UHFFFAOYSA-N
XLogP1.08
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine?
The IUPAC name of 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine (CID 116938957) is 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine.
What is the SMILES notation for 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine?
The canonical SMILES for 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine is CNC(C)(C)C(N)c1ccccn1.
What is the InChIKey of 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine?
The InChIKey is SEDOMTPTVFJOPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-10(2,12-3)9(11)8-6-4-5-7-13-8/h4-7,9,12H,11H2,1-3H3.
What are the key properties of 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine?
2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine has a molecular weight of 179.27 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-dimethyl-1-pyridin-2-ylpropane-1,2-diamine is sourced from PubChem (CID 116938957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).