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

C10H17N3 — CID 112757188

IUPAC2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine
SMILESCc1ccncc1NC(C)(C)CN
InChIInChI=1S/C10H17N3/c1-8-4-5-12-6-9(8)13-10(2,3)7-11/h4-6,13H,7,11H2,1-3H3
InChIKeyFEYGRFJKSGTRHH-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.54
Rot. Bonds3

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

2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine (PubChem CID 112757188) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine
PubChem CID112757188
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine
SMILESCc1ccncc1NC(C)(C)CN
InChIInChI=1S/C10H17N3/c1-8-4-5-12-6-9(8)13-10(2,3)7-11/h4-6,13H,7,11H2,1-3H3
InChIKeyFEYGRFJKSGTRHH-UHFFFAOYSA-N
XLogP1.54
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 ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine?
The IUPAC name of 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine (CID 112757188) is 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine.
What is the SMILES notation for 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine?
The canonical SMILES for 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine is Cc1ccncc1NC(C)(C)CN.
What is the InChIKey of 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine?
The InChIKey is FEYGRFJKSGTRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-4-5-12-6-9(8)13-10(2,3)7-11/h4-6,13H,7,11H2,1-3H3.
What are the key properties of 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine?
2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine has a molecular weight of 179.27 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-N-(4-methyl-3-pyridinyl)propane-1,2-diamine is sourced from PubChem (CID 112757188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).