1-benzylimidazolidine;hydrochloride

C10H15ClN2 — CID 141144988

IUPAC1-benzylimidazolidine;hydrochloride
SMILESCl.c1ccc(CN2CCNC2)cc1
InChIInChI=1S/C10H14N2.ClH/c1-2-4-10(5-3-1)8-12-7-6-11-9-12;/h1-5,11H,6-9H2;1H
InChIKeyYYRUGYKNYVXBGP-UHFFFAOYSA-N
MW198.70 g/mol
LogP1.47
Rot. Bonds2

About 1-benzylimidazolidine;hydrochloride

1-benzylimidazolidine;hydrochloride (PubChem CID 141144988) has the molecular formula C10H15ClN2 and a molecular weight of 198.70 g/mol. Its IUPAC name is 1-benzylimidazolidine;hydrochloride.

Molecular Properties

Compound Name1-benzylimidazolidine;hydrochloride
PubChem CID141144988
Molecular FormulaC10H15ClN2
Molecular Weight198.70 g/mol
Exact Mass198.09
IUPAC Name1-benzylimidazolidine;hydrochloride
SMILESCl.c1ccc(CN2CCNC2)cc1
InChIInChI=1S/C10H14N2.ClH/c1-2-4-10(5-3-1)8-12-7-6-11-9-12;/h1-5,11H,6-9H2;1H
InChIKeyYYRUGYKNYVXBGP-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.70
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
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bis(1-(2-phenylethyl)piperazine);dihydrochloride
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6-benzyl-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-triene
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(3S)-1-benzyl-3-methylpiperazine;hydrochloride
CID 52982949
1-[(3-methylphenyl)methyl]piperazine;dihydrochloride
CID 3014358
1-[(3-fluorophenyl)methyl]piperazine;dihydrochloride
CID 53422102
1-[(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)methyl]piperazine
CID 117206009
[(6S)-1-benzyl-1,4-diazepan-6-yl]methanol
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Frequently Asked Questions

What is the IUPAC name of 1-benzylimidazolidine;hydrochloride?
The IUPAC name of 1-benzylimidazolidine;hydrochloride (CID 141144988) is 1-benzylimidazolidine;hydrochloride.
What is the SMILES notation for 1-benzylimidazolidine;hydrochloride?
The canonical SMILES for 1-benzylimidazolidine;hydrochloride is Cl.c1ccc(CN2CCNC2)cc1.
What is the InChIKey of 1-benzylimidazolidine;hydrochloride?
The InChIKey is YYRUGYKNYVXBGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.ClH/c1-2-4-10(5-3-1)8-12-7-6-11-9-12;/h1-5,11H,6-9H2;1H.
What are the key properties of 1-benzylimidazolidine;hydrochloride?
1-benzylimidazolidine;hydrochloride has a molecular weight of 198.70 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylimidazolidine;hydrochloride is sourced from PubChem (CID 141144988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).