3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide

C20H28N2O3 — CID 42120029

IUPAC3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2)cc1OC1CCN(C2CCC2)CC1
InChIInChI=1S/C20H28N2O3/c1-24-18-8-5-14(20(23)21-15-6-7-15)13-19(18)25-17-9-11-22(12-10-17)16-3-2-4-16/h5,8,13,15-17H,2-4,6-7,9-12H2,1H3,(H,21,23)
InChIKeyJLRJZWHSYPKMPT-UHFFFAOYSA-N
MW344.45 g/mol
LogP2.98
Rot. Bonds6

About 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide

3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide (PubChem CID 42120029) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide.

Molecular Properties

Compound Name3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide
PubChem CID42120029
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC Name3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2)cc1OC1CCN(C2CCC2)CC1
InChIInChI=1S/C20H28N2O3/c1-24-18-8-5-14(20(23)21-15-6-7-15)13-19(18)25-17-9-11-22(12-10-17)16-3-2-4-16/h5,8,13,15-17H,2-4,6-7,9-12H2,1H3,(H,21,23)
InChIKeyJLRJZWHSYPKMPT-UHFFFAOYSA-N
XLogP2.98
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-cyclopentylpiperidin-4-yl)oxy-3-methoxy-N-pyrrolidin-3-ylbenzamide;dihydrochloride
CID 154900150
3-(1-cycloheptylpiperidin-4-yl)oxy-N-[2-(dimethylamino)ethyl]-4-methoxybenzamide
CID 26408301
4-(1-cyclopentylpiperidin-4-yl)oxy-N-ethyl-3-methoxybenzamide
CID 72907605
N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride
CID 67897205
N-cyclopropyl-4-methoxy-3-[1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]piperidin-4-yl]oxybenzamide
CID 24817407
N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide
CID 110752030
N-cyclopropyl-4-methoxy-3-[1-(3-phenylbutyl)piperidin-4-yl]oxybenzamide
CID 45232215
N-cyclobutyl-4-methoxy-3-methylbenzamide
CID 121342416
N-(4-bromocyclohexyl)-3,4-dimethoxybenzamide
CID 114309034
3,4-dimethoxy-N-(1-methylsulfonylpiperidin-4-yl)benzamide
CID 5017279
3-cyclopentyloxy-4-methoxy-N-[(3S)-5-oxopyrrolidin-3-yl]benzamide
CID 10313807
N-cyclopropyl-2-[4-(2-methoxyphenoxy)piperidin-1-yl]pyridine-4-carboxamide
CID 72916898

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide?
The IUPAC name of 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide (CID 42120029) is 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide.
What is the SMILES notation for 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide?
The canonical SMILES for 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide is COc1ccc(C(=O)NC2CC2)cc1OC1CCN(C2CCC2)CC1.
What is the InChIKey of 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide?
The InChIKey is JLRJZWHSYPKMPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-24-18-8-5-14(20(23)21-15-6-7-15)13-19(18)25-17-9-11-22(12-10-17)16-3-2-4-16/h5,8,13,15-17H,2-4,6-7,9-12H2,1H3,(H,21,23).
What are the key properties of 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide?
3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide has a molecular weight of 344.45 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide is sourced from PubChem (CID 42120029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).