4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine

C9H16N4 — CID 176519657

IUPAC4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine
SMILESCN1CNCC1C1CCN=C=C1N
InChIInChI=1S/C9H16N4/c1-13-6-12-5-9(13)7-2-3-11-4-8(7)10/h7,9,12H,2-3,5-6,10H2,1H3
InChIKeyUGDBBDSYWSZBFE-UHFFFAOYSA-N
MW180.25 g/mol
LogP-0.62
Rot. Bonds1

About 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine

4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine (PubChem CID 176519657) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine.

Molecular Properties

Compound Name4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine
PubChem CID176519657
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC Name4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine
SMILESCN1CNCC1C1CCN=C=C1N
InChIInChI=1S/C9H16N4/c1-13-6-12-5-9(13)7-2-3-11-4-8(7)10/h7,9,12H,2-3,5-6,10H2,1H3
InChIKeyUGDBBDSYWSZBFE-UHFFFAOYSA-N
XLogP-0.62
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine?
The IUPAC name of 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine (CID 176519657) is 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine.
What is the SMILES notation for 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine?
The canonical SMILES for 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine is CN1CNCC1C1CCN=C=C1N.
What is the InChIKey of 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine?
The InChIKey is UGDBBDSYWSZBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-13-6-12-5-9(13)7-2-3-11-4-8(7)10/h7,9,12H,2-3,5-6,10H2,1H3.
What are the key properties of 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine?
4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine has a molecular weight of 180.25 g/mol, XLogP of -0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylimidazolidin-4-yl)-3,4-dihydro-2H-pyridin-5-amine is sourced from PubChem (CID 176519657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).