7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride

C8H11Cl2N3 — CID 21320115

IUPAC7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride
SMILESCCC1=NC(Cl)=CC2=NCCN21.Cl
InChIInChI=1S/C8H10ClN3.ClH/c1-2-7-11-6(9)5-8-10-3-4-12(7)8;/h5H,2-4H2,1H3;1H
InChIKeyODBRBWOACPKROW-UHFFFAOYSA-N
MW220.10 g/mol
LogP2.02
Rot. Bonds1

About 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride

7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride (PubChem CID 21320115) has the molecular formula C8H11Cl2N3 and a molecular weight of 220.10 g/mol. Its IUPAC name is 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride.

Molecular Properties

Compound Name7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride
PubChem CID21320115
Molecular FormulaC8H11Cl2N3
Molecular Weight220.10 g/mol
Exact Mass219.03
IUPAC Name7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride
SMILESCCC1=NC(Cl)=CC2=NCCN21.Cl
InChIInChI=1S/C8H10ClN3.ClH/c1-2-7-11-6(9)5-8-10-3-4-12(7)8;/h5H,2-4H2,1H3;1H
InChIKeyODBRBWOACPKROW-UHFFFAOYSA-N
XLogP2.02
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.10
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride?
The IUPAC name of 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride (CID 21320115) is 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride.
What is the SMILES notation for 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride?
The canonical SMILES for 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride is CCC1=NC(Cl)=CC2=NCCN21.Cl.
What is the InChIKey of 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride?
The InChIKey is ODBRBWOACPKROW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3.ClH/c1-2-7-11-6(9)5-8-10-3-4-12(7)8;/h5H,2-4H2,1H3;1H.
What are the key properties of 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride?
7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride has a molecular weight of 220.10 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidine;hydrochloride is sourced from PubChem (CID 21320115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).