(1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride

C15H21ClN2O2 — CID 119725071

IUPAC(1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride
SMILESCl.NC1(C(=O)N2CCC(Oc3ccccc3)CC2)CC1
InChIInChI=1S/C15H20N2O2.ClH/c16-15(8-9-15)14(18)17-10-6-13(7-11-17)19-12-4-2-1-3-5-12;/h1-5,13H,6-11,16H2;1H
InChIKeyAKRXKPZJYNPXAD-UHFFFAOYSA-N
MW296.80 g/mol
LogP1.97
Rot. Bonds3

About (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride

(1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride (PubChem CID 119725071) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride.

Molecular Properties

Compound Name(1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride
PubChem CID119725071
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name(1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride
SMILESCl.NC1(C(=O)N2CCC(Oc3ccccc3)CC2)CC1
InChIInChI=1S/C15H20N2O2.ClH/c16-15(8-9-15)14(18)17-10-6-13(7-11-17)19-12-4-2-1-3-5-12;/h1-5,13H,6-11,16H2;1H
InChIKeyAKRXKPZJYNPXAD-UHFFFAOYSA-N
XLogP1.97
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-aminocyclohexyl)-(4-phenoxypiperidin-1-yl)methanone
CID 119290343
(1-aminocyclohexyl)-[4-(4-fluorophenoxy)piperidin-1-yl]methanone;hydrochloride
CID 119308982
(1-aminocyclohexyl)-[4-(4-methylphenoxy)piperidin-1-yl]methanone
CID 119292106
(4-aminophenyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride
CID 119725091
phenyl 4-phenoxypiperidine-1-carboxylate
CID 110396730
2-amino-1-(4-phenoxypiperidin-1-yl)-2-phenylpropan-1-one;hydrochloride
CID 120589033
(1-aminocyclopropyl)-[3-(3-phenylpropoxy)pyrrolidin-1-yl]methanone;hydrochloride
CID 119815537
(1-aminocyclopentyl)-(4-phenylpiperidin-1-yl)methanone;hydrochloride
CID 119278406
2-amino-1-(4-phenoxypiperidin-1-yl)-2-phenylethanone;hydrochloride
CID 119290335
(1-aminocyclopentyl)-[4-(phenoxymethyl)piperidin-1-yl]methanone
CID 119304906
(1-aminocyclopropyl)-(4-phenylazepan-1-yl)methanone
CID 119770810
2-(cyclopropylamino)-1-(4-phenoxypiperidin-1-yl)ethanone
CID 60858362

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride?
The IUPAC name of (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride (CID 119725071) is (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride.
What is the SMILES notation for (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride?
The canonical SMILES for (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride is Cl.NC1(C(=O)N2CCC(Oc3ccccc3)CC2)CC1.
What is the InChIKey of (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride?
The InChIKey is AKRXKPZJYNPXAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2.ClH/c16-15(8-9-15)14(18)17-10-6-13(7-11-17)19-12-4-2-1-3-5-12;/h1-5,13H,6-11,16H2;1H.
What are the key properties of (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride?
(1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride has a molecular weight of 296.80 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopropyl)-(4-phenoxypiperidin-1-yl)methanone;hydrochloride is sourced from PubChem (CID 119725071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).