5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride

C8H10Cl2N4 — CID 118730398

IUPAC5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride
SMILESCl.Clc1ccc(NC2=NCCN2)nc1
InChIInChI=1S/C8H9ClN4.ClH/c9-6-1-2-7(12-5-6)13-8-10-3-4-11-8;/h1-2,5H,3-4H2,(H2,10,11,12,13);1H
InChIKeyWTDFAIHZDDJUTJ-UHFFFAOYSA-N
MW233.10 g/mol
LogP1.53
Rot. Bonds1

About 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride

5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride (PubChem CID 118730398) has the molecular formula C8H10Cl2N4 and a molecular weight of 233.10 g/mol. Its IUPAC name is 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride
PubChem CID118730398
Molecular FormulaC8H10Cl2N4
Molecular Weight233.10 g/mol
Exact Mass232.03
IUPAC Name5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride
SMILESCl.Clc1ccc(NC2=NCCN2)nc1
InChIInChI=1S/C8H9ClN4.ClH/c9-6-1-2-7(12-5-6)13-8-10-3-4-11-8;/h1-2,5H,3-4H2,(H2,10,11,12,13);1H
InChIKeyWTDFAIHZDDJUTJ-UHFFFAOYSA-N
XLogP1.53
TPSA49.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.10
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride?
The IUPAC name of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride (CID 118730398) is 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride.
What is the SMILES notation for 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride?
The canonical SMILES for 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride is Cl.Clc1ccc(NC2=NCCN2)nc1.
What is the InChIKey of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride?
The InChIKey is WTDFAIHZDDJUTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN4.ClH/c9-6-1-2-7(12-5-6)13-8-10-3-4-11-8;/h1-2,5H,3-4H2,(H2,10,11,12,13);1H.
What are the key properties of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride?
5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride has a molecular weight of 233.10 g/mol, XLogP of 1.53, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride is sourced from PubChem (CID 118730398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).