3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride

C19H22ClN3O — CID 120854907

IUPAC3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride
SMILESCl.O=C1CN(Cc2cccc3c2NCC3)CN1Cc1ccccc1
InChIInChI=1S/C19H21N3O.ClH/c23-18-13-21(14-22(18)11-15-5-2-1-3-6-15)12-17-8-4-7-16-9-10-20-19(16)17;/h1-8,20H,9-14H2;1H
InChIKeyAUFQMQJINGUERN-UHFFFAOYSA-N
MW343.86 g/mol
LogP2.88
Rot. Bonds4

About 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride

3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride (PubChem CID 120854907) has the molecular formula C19H22ClN3O and a molecular weight of 343.86 g/mol. Its IUPAC name is 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride.

Molecular Properties

Compound Name3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride
PubChem CID120854907
Molecular FormulaC19H22ClN3O
Molecular Weight343.86 g/mol
Exact Mass343.15
IUPAC Name3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride
SMILESCl.O=C1CN(Cc2cccc3c2NCC3)CN1Cc1ccccc1
InChIInChI=1S/C19H21N3O.ClH/c23-18-13-21(14-22(18)11-15-5-2-1-3-6-15)12-17-8-4-7-16-9-10-20-19(16)17;/h1-8,20H,9-14H2;1H
InChIKeyAUFQMQJINGUERN-UHFFFAOYSA-N
XLogP2.88
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.86
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride
CID 120857366
4-(2,3-dihydro-1H-indol-7-ylmethyl)-1-(2-methylpropyl)piperazin-2-one;hydrochloride
CID 120849423
1-(2,3-dihydro-1H-indol-7-ylmethyl)pyrrolidine-3,4-diol;hydrochloride
CID 120849941
N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine
CID 80649878
[4-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)piperidin-4-yl]methanol
CID 120858037
7-[(4-cyclopropylpiperazin-1-yl)methyl]-2,3-dihydro-1H-indole
CID 114327111
1-[4-(2,3-dihydro-1H-indol-7-ylmethyl)piperazin-1-yl]ethanone
CID 114326996
6-(2,3-dihydro-1H-indol-7-ylmethyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one;hydrochloride
CID 120849479
4-(2,3-dihydro-1H-indol-7-ylmethyl)-1-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine;hydrochloride
CID 120855200
7-[(3,5-dimethylpiperidin-1-yl)methyl]-2,3-dihydro-1H-indole
CID 113277959
1-(2,3-dihydro-1H-indol-7-ylmethyl)piperidine-4-sulfonamide;hydrochloride
CID 120848251
6-(2,3-dihydro-1H-indol-7-ylmethyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-one
CID 120849480

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride?
The IUPAC name of 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride (CID 120854907) is 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride.
What is the SMILES notation for 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride?
The canonical SMILES for 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride is Cl.O=C1CN(Cc2cccc3c2NCC3)CN1Cc1ccccc1.
What is the InChIKey of 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride?
The InChIKey is AUFQMQJINGUERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O.ClH/c23-18-13-21(14-22(18)11-15-5-2-1-3-6-15)12-17-8-4-7-16-9-10-20-19(16)17;/h1-8,20H,9-14H2;1H.
What are the key properties of 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride?
3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride has a molecular weight of 343.86 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-1-(2,3-dihydro-1H-indol-7-ylmethyl)imidazolidin-4-one;hydrochloride is sourced from PubChem (CID 120854907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).