cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride

C22H27ClN2O — CID 56808716

IUPACcyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride
SMILESCl.O=C(C1CC1)N1CCC(NCc2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C22H26N2O.ClH/c25-22(20-10-11-20)24-14-12-21(13-15-24)23-16-17-6-8-19(9-7-17)18-4-2-1-3-5-18;/h1-9,20-21,23H,10-16H2;1H
InChIKeyOUMHPYIOEHAGLF-UHFFFAOYSA-N
MW370.92 g/mol
LogP4.27
Rot. Bonds5

About cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride

cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride (PubChem CID 56808716) has the molecular formula C22H27ClN2O and a molecular weight of 370.92 g/mol. Its IUPAC name is cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride.

Molecular Properties

Compound Namecyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride
PubChem CID56808716
Molecular FormulaC22H27ClN2O
Molecular Weight370.92 g/mol
Exact Mass370.18
IUPAC Namecyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride
SMILESCl.O=C(C1CC1)N1CCC(NCc2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C22H26N2O.ClH/c25-22(20-10-11-20)24-14-12-21(13-15-24)23-16-17-6-8-19(9-7-17)18-4-2-1-3-5-18;/h1-9,20-21,23H,10-16H2;1H
InChIKeyOUMHPYIOEHAGLF-UHFFFAOYSA-N
XLogP4.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.92
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-[4-[(2-hydroxyphenyl)methylamino]piperidin-1-yl]methanone
CID 43747864
cyclopropyl-[4-[[3-(2-methylphenyl)phenyl]methylamino]piperidin-1-yl]methanone
CID 56827303
cyclopropyl-[4-[(3,4-difluorophenyl)methylamino]piperidin-1-yl]methanone
CID 43434746
cyclopropyl-[4-[(3,4-dimethylphenyl)methylamino]piperidin-1-yl]methanone
CID 43434758
cyclopropyl-[4-[(2,6-dichlorophenyl)methylamino]piperidin-1-yl]methanone
CID 43434750
1-methyl-N-[(4-phenylphenyl)methyl]piperidin-4-amine
CID 43215927
1-benzyl-N-[(4-phenylphenyl)methyl]piperidin-4-amine;dihydrochloride
CID 17159249
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-(4-phenylphenyl)ethanone
CID 43009927
4-(benzylamino)piperidine-1-carboxamide
CID 43757030
[4-[(3-chloro-4-methylphenyl)methylamino]piperidin-1-yl]-cyclopropylmethanone
CID 106816549
cyclopropyl-[4-[(3,5-dichlorophenyl)methylamino]piperidin-1-yl]methanone
CID 60789546
cyclopropyl-[4-(pyridin-2-ylmethylamino)piperidin-1-yl]methanone
CID 43434771

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride?
The IUPAC name of cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride (CID 56808716) is cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride.
What is the SMILES notation for cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride?
The canonical SMILES for cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride is Cl.O=C(C1CC1)N1CCC(NCc2ccc(-c3ccccc3)cc2)CC1.
What is the InChIKey of cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride?
The InChIKey is OUMHPYIOEHAGLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O.ClH/c25-22(20-10-11-20)24-14-12-21(13-15-24)23-16-17-6-8-19(9-7-17)18-4-2-1-3-5-18;/h1-9,20-21,23H,10-16H2;1H.
What are the key properties of cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride?
cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride has a molecular weight of 370.92 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride is sourced from PubChem (CID 56808716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).