1-benzyl-4-phenylmethoxypiperidine;hydrochloride

C19H24ClNO — CID 18919828

IUPAC1-benzyl-4-phenylmethoxypiperidine;hydrochloride
SMILESCl.c1ccc(COC2CCN(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C19H23NO.ClH/c1-3-7-17(8-4-1)15-20-13-11-19(12-14-20)21-16-18-9-5-2-6-10-18;/h1-10,19H,11-16H2;1H
InChIKeyIKTZZZJVZFVLNI-UHFFFAOYSA-N
MW317.86 g/mol
LogP4.29
Rot. Bonds5

About 1-benzyl-4-phenylmethoxypiperidine;hydrochloride

1-benzyl-4-phenylmethoxypiperidine;hydrochloride (PubChem CID 18919828) has the molecular formula C19H24ClNO and a molecular weight of 317.86 g/mol. Its IUPAC name is 1-benzyl-4-phenylmethoxypiperidine;hydrochloride.

Molecular Properties

Compound Name1-benzyl-4-phenylmethoxypiperidine;hydrochloride
PubChem CID18919828
Molecular FormulaC19H24ClNO
Molecular Weight317.86 g/mol
Exact Mass317.15
IUPAC Name1-benzyl-4-phenylmethoxypiperidine;hydrochloride
SMILESCl.c1ccc(COC2CCN(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C19H23NO.ClH/c1-3-7-17(8-4-1)15-20-13-11-19(12-14-20)21-16-18-9-5-2-6-10-18;/h1-10,19H,11-16H2;1H
InChIKeyIKTZZZJVZFVLNI-UHFFFAOYSA-N
XLogP4.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.86
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-4-phenylmethoxypiperidine
CID 15892976
1-benzyl-4-[(3,4,5-trimethoxyphenyl)methoxy]piperidine
CID 13194422
4-phenylmethoxy-1-prop-2-enylpiperidine
CID 57075697
2-methyl-5-[(4-phenylmethoxypiperidin-1-yl)methyl]-1,3,4-thiadiazole
CID 118782893
2-(furan-2-yl)-5-[(4-phenylmethoxypiperidin-1-yl)methyl]pyrimidine
CID 56915979
1-benzyl-4-(piperidin-4-ylmethoxy)piperidine
CID 67802742
O-(1-benzylpyrrolidin-3-yl)hydroxylamine;hydrochloride
CID 142714057
5-[(4-phenylmethoxypiperidin-1-yl)methyl]quinoxaline
CID 56901960
2-[(4-phenylmethoxypiperidin-1-yl)methyl]isoindole-1,3-dione
CID 17416201
3-(1-benzylpiperidin-4-yl)oxypropanamide
CID 2779233
2-(2-chlorophenyl)-5-[(4-phenylmethoxypiperidin-1-yl)methyl]-1,3,4-oxadiazole
CID 55470479
azane;cyclopentyloxymethylbenzene
CID 69411306

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-phenylmethoxypiperidine;hydrochloride?
The IUPAC name of 1-benzyl-4-phenylmethoxypiperidine;hydrochloride (CID 18919828) is 1-benzyl-4-phenylmethoxypiperidine;hydrochloride.
What is the SMILES notation for 1-benzyl-4-phenylmethoxypiperidine;hydrochloride?
The canonical SMILES for 1-benzyl-4-phenylmethoxypiperidine;hydrochloride is Cl.c1ccc(COC2CCN(Cc3ccccc3)CC2)cc1.
What is the InChIKey of 1-benzyl-4-phenylmethoxypiperidine;hydrochloride?
The InChIKey is IKTZZZJVZFVLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO.ClH/c1-3-7-17(8-4-1)15-20-13-11-19(12-14-20)21-16-18-9-5-2-6-10-18;/h1-10,19H,11-16H2;1H.
What are the key properties of 1-benzyl-4-phenylmethoxypiperidine;hydrochloride?
1-benzyl-4-phenylmethoxypiperidine;hydrochloride has a molecular weight of 317.86 g/mol, XLogP of 4.29, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-phenylmethoxypiperidine;hydrochloride is sourced from PubChem (CID 18919828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).