[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone

C20H24N2O2 — CID 124688652

IUPAC[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone
SMILESCOc1ccc(C(=O)N2CCCC[C@@H]2CN)cc1-c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-24-19-11-10-16(13-18(19)15-7-3-2-4-8-15)20(23)22-12-6-5-9-17(22)14-21/h2-4,7-8,10-11,13,17H,5-6,9,12,14,21H2,1H3/t17-/m1/s1
InChIKeyFAQLOALOFMTZFL-QGZVFWFLSA-N
MW324.42 g/mol
LogP3.32
Rot. Bonds4

About [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone

[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone (PubChem CID 124688652) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone.

Molecular Properties

Compound Name[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone
PubChem CID124688652
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone
SMILESCOc1ccc(C(=O)N2CCCC[C@@H]2CN)cc1-c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-24-19-11-10-16(13-18(19)15-7-3-2-4-8-15)20(23)22-12-6-5-9-17(22)14-21/h2-4,7-8,10-11,13,17H,5-6,9,12,14,21H2,1H3/t17-/m1/s1
InChIKeyFAQLOALOFMTZFL-QGZVFWFLSA-N
XLogP3.32
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(aminomethyl)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone
CID 63753428
[2-(aminomethyl)piperidin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone;hydrochloride
CID 119468153
[2-(aminomethyl)piperidin-1-yl]-(4-cyclopentyloxy-3-methoxyphenyl)methanone;hydrochloride
CID 119467821
[2-(aminomethyl)piperidin-1-yl]-[3-methoxy-4-(3-methylbutoxy)phenyl]methanone;hydrochloride
CID 119468928
1-(4-methoxy-3-phenylbenzoyl)piperidine-4-carboxamide
CID 49316648
5-[2-(aminomethyl)piperidine-1-carbonyl]-2-methoxy-N-methylbenzenesulfonamide;hydrochloride
CID 119468592
[2-(aminomethyl)piperidin-1-yl]-(3-methoxy-4-nitrophenyl)methanone;hydrochloride
CID 119467805
1-[5-[(2S)-2-(aminomethyl)piperidine-1-carbonyl]-2-methoxyphenyl]imidazolidin-2-one
CID 124573528
5-[2-(aminomethyl)piperidine-1-carbonyl]-N-cyclopentyl-2-methoxybenzenesulfonamide
CID 119467121
[2-(aminomethyl)pyrrolidin-1-yl]-(4-butoxy-3-methoxyphenyl)methanone
CID 119632890
[(2S)-2-(aminomethyl)piperidin-1-yl]-[4-(2-chlorophenyl)phenyl]methanone
CID 126432406
[2-(aminomethyl)piperidin-1-yl]-(3,4-dipropoxyphenyl)methanone;hydrochloride
CID 119469137

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone?
The IUPAC name of [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone (CID 124688652) is [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone.
What is the SMILES notation for [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone?
The canonical SMILES for [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone is COc1ccc(C(=O)N2CCCC[C@@H]2CN)cc1-c1ccccc1.
What is the InChIKey of [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone?
The InChIKey is FAQLOALOFMTZFL-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-24-19-11-10-16(13-18(19)15-7-3-2-4-8-15)20(23)22-12-6-5-9-17(22)14-21/h2-4,7-8,10-11,13,17H,5-6,9,12,14,21H2,1H3/t17-/m1/s1.
What are the key properties of [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone?
[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone has a molecular weight of 324.42 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone is sourced from PubChem (CID 124688652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).