1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine

C11H17N3 — CID 130806046

IUPAC1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine
SMILESCc1cccc(C(N)C(N)C2CC2)n1
InChIInChI=1S/C11H17N3/c1-7-3-2-4-9(14-7)11(13)10(12)8-5-6-8/h2-4,8,10-11H,5-6,12-13H2,1H3
InChIKeyCWENOZBPHPPIKK-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.13
Rot. Bonds3

About 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine

1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine (PubChem CID 130806046) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine
PubChem CID130806046
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine
SMILESCc1cccc(C(N)C(N)C2CC2)n1
InChIInChI=1S/C11H17N3/c1-7-3-2-4-9(14-7)11(13)10(12)8-5-6-8/h2-4,8,10-11H,5-6,12-13H2,1H3
InChIKeyCWENOZBPHPPIKK-UHFFFAOYSA-N
XLogP1.13
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine?
The IUPAC name of 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine (CID 130806046) is 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine.
What is the SMILES notation for 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine?
The canonical SMILES for 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine is Cc1cccc(C(N)C(N)C2CC2)n1.
What is the InChIKey of 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine?
The InChIKey is CWENOZBPHPPIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-7-3-2-4-9(14-7)11(13)10(12)8-5-6-8/h2-4,8,10-11H,5-6,12-13H2,1H3.
What are the key properties of 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine?
1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine has a molecular weight of 191.28 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(6-methyl-2-pyridinyl)ethane-1,2-diamine is sourced from PubChem (CID 130806046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).