(4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride

C16H23ClN2O — CID 119374083

IUPAC(4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride
SMILESCl.NC1CCN(C(=O)C2(c3ccccc3)CCC2)CC1
InChIInChI=1S/C16H22N2O.ClH/c17-14-7-11-18(12-8-14)15(19)16(9-4-10-16)13-5-2-1-3-6-13;/h1-3,5-6,14H,4,7-12,17H2;1H
InChIKeyCWFXFTZSCBYYPV-UHFFFAOYSA-N
MW294.83 g/mol
LogP2.48
Rot. Bonds2

About (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride

(4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride (PubChem CID 119374083) has the molecular formula C16H23ClN2O and a molecular weight of 294.83 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride
PubChem CID119374083
Molecular FormulaC16H23ClN2O
Molecular Weight294.83 g/mol
Exact Mass294.15
IUPAC Name(4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride
SMILESCl.NC1CCN(C(=O)C2(c3ccccc3)CCC2)CC1
InChIInChI=1S/C16H22N2O.ClH/c17-14-7-11-18(12-8-14)15(19)16(9-4-10-16)13-5-2-1-3-6-13;/h1-3,5-6,14H,4,7-12,17H2;1H
InChIKeyCWFXFTZSCBYYPV-UHFFFAOYSA-N
XLogP2.48
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(3S)-3-aminopyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119934201
(4-aminopiperidin-1-yl)-[1-(4-bromophenyl)cyclobutyl]methanone
CID 119375691
[4-(aminomethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 166001503
(4-aminopiperidin-1-yl)-[1-(3-methylphenyl)cyclohexyl]methanone;hydrochloride
CID 119376299
(4-aminopiperidin-1-yl)-[1-(4-bromophenyl)cyclopropyl]methanone;hydrochloride
CID 119375609
(1-phenylcyclobutyl)-piperazin-1-ylmethanone
CID 110463899
[4-(methylamino)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119560283
ethane;(4-methylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 144893493
1-phenyl-3-[1-(1-phenylcyclobutanecarbonyl)piperidin-4-yl]urea
CID 86834895
[(3R)-3-aminopyrrolidin-1-yl]-[1-(4-chlorophenyl)cyclohexyl]methanone;hydrochloride
CID 119409853
cyclobutyl-[4-(1-phenylcyclopropanecarbonyl)piperazin-1-yl]methanone
CID 75369417
(1-phenylcyclopentyl)-(4-phenylpiperazin-1-yl)methanone
CID 4048114

Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride?
The IUPAC name of (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride (CID 119374083) is (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride.
What is the SMILES notation for (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride?
The canonical SMILES for (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride is Cl.NC1CCN(C(=O)C2(c3ccccc3)CCC2)CC1.
What is the InChIKey of (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride?
The InChIKey is CWFXFTZSCBYYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O.ClH/c17-14-7-11-18(12-8-14)15(19)16(9-4-10-16)13-5-2-1-3-6-13;/h1-3,5-6,14H,4,7-12,17H2;1H.
What are the key properties of (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride?
(4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride has a molecular weight of 294.83 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminopiperidin-1-yl)-(1-phenylcyclobutyl)methanone;hydrochloride is sourced from PubChem (CID 119374083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).