[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone

C17H23NO2 — CID 103677890

IUPAC[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
SMILESCC(O)C1CCN(C(=O)C2(c3ccccc3)CC2)CC1
InChIInChI=1S/C17H23NO2/c1-13(19)14-7-11-18(12-8-14)16(20)17(9-10-17)15-5-3-2-4-6-15/h2-6,13-14,19H,7-12H2,1H3
InChIKeyBKJGWKISYKQIAD-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.34
Rot. Bonds3

About [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone

[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone (PubChem CID 103677890) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
PubChem CID103677890
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
SMILESCC(O)C1CCN(C(=O)C2(c3ccccc3)CC2)CC1
InChIInChI=1S/C17H23NO2/c1-13(19)14-7-11-18(12-8-14)16(20)17(9-10-17)15-5-3-2-4-6-15/h2-6,13-14,19H,7-12H2,1H3
InChIKeyBKJGWKISYKQIAD-UHFFFAOYSA-N
XLogP2.34
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(4-fluorophenyl)cyclopropyl]-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 103677994
ethane;(4-methylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 144893493
[1-(3-fluorophenyl)cyclobutyl]-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 111430036
[4-(methylamino)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119560283
[1-(3-bromophenyl)cyclopropyl]-[3-(1-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 110022790
(3-chloropyrrolidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 63394917
[(3R)-3-hydroxypyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 66262419
[4-(aminomethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 166001503
(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 81457070
4-(1-hydroxyethyl)-N-[(1-phenylcyclopropyl)methyl]piperidine-1-carboxamide
CID 111438064
N-cyclopropyl-2-[4-(1-phenylcyclopropanecarbonyl)piperazin-1-yl]propanamide
CID 51329077
1-[4-phenyl-4-(4-phenylpiperidine-1-carbonyl)piperidin-1-yl]ethanone
CID 39581896

Frequently Asked Questions

What is the IUPAC name of [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
The IUPAC name of [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone (CID 103677890) is [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
The canonical SMILES for [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone is CC(O)C1CCN(C(=O)C2(c3ccccc3)CC2)CC1.
What is the InChIKey of [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
The InChIKey is BKJGWKISYKQIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-13(19)14-7-11-18(12-8-14)16(20)17(9-10-17)15-5-3-2-4-6-15/h2-6,13-14,19H,7-12H2,1H3.
What are the key properties of [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone has a molecular weight of 273.38 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 103677890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).