N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide

C25H30N2O4 — CID 53150228

IUPACN-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide
SMILESCOc1ccc(C(=O)N2CCCC(COc3ccc(C(=O)NC4CC4)cc3)C2)c(C)c1
InChIInChI=1S/C25H30N2O4/c1-17-14-22(30-2)11-12-23(17)25(29)27-13-3-4-18(15-27)16-31-21-9-5-19(6-10-21)24(28)26-20-7-8-20/h5-6,9-12,14,18,20H,3-4,7-8,13,15-16H2,1-2H3,(H,26,28)
InChIKeyOHVBZVJSZFULRU-UHFFFAOYSA-N
MW422.53 g/mol
LogP3.83
Rot. Bonds7

About N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide

N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide (PubChem CID 53150228) has the molecular formula C25H30N2O4 and a molecular weight of 422.53 g/mol. Its IUPAC name is N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide
PubChem CID53150228
Molecular FormulaC25H30N2O4
Molecular Weight422.53 g/mol
Exact Mass422.22
IUPAC NameN-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide
SMILESCOc1ccc(C(=O)N2CCCC(COc3ccc(C(=O)NC4CC4)cc3)C2)c(C)c1
InChIInChI=1S/C25H30N2O4/c1-17-14-22(30-2)11-12-23(17)25(29)27-13-3-4-18(15-27)16-31-21-9-5-19(6-10-21)24(28)26-20-7-8-20/h5-6,9-12,14,18,20H,3-4,7-8,13,15-16H2,1-2H3,(H,26,28)
InChIKeyOHVBZVJSZFULRU-UHFFFAOYSA-N
XLogP3.83
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-4-[[(3R)-1-(4-methylbenzoyl)piperidin-3-yl]methoxy]benzamide
CID 95097896
N-cyclopropyl-4-[[(3R)-1-(2,4-difluorobenzoyl)piperidin-3-yl]methoxy]benzamide
CID 95097851
4-[[(3R)-1-(2-chloro-4-fluorobenzoyl)piperidin-3-yl]methoxy]-N-cyclopropylbenzamide
CID 95097845
N-cyclopropyl-4-[[(3S)-1-(4-ethylbenzoyl)piperidin-3-yl]methoxy]benzamide
CID 95097799
4-[[1-(4-chlorobenzoyl)piperidin-3-yl]methoxy]-N-cyclopropylbenzamide
CID 53150189
N-cyclopropyl-3-[[(3R)-1-(4-methoxybenzoyl)piperidin-3-yl]methoxy]benzamide
CID 92901057
N-cyclopropyl-4-[[(3R)-1-(3,4-difluorobenzoyl)piperidin-3-yl]methoxy]benzamide
CID 95097835
[4-[[(3R)-1-(2,4-dimethylbenzoyl)piperidin-3-yl]methoxy]phenyl]-pyrrolidin-1-ylmethanone
CID 95097584
4-[[(3S)-1-(3,4-dimethylbenzoyl)piperidin-3-yl]methoxy]-N-propan-2-ylbenzamide
CID 95097911
N-cyclopropyl-4-[[(3S)-1-(1-phenylcyclopropanecarbonyl)piperidin-3-yl]methoxy]benzamide
CID 95097877
N-cyclopropyl-3-[[(3S)-1-(4-propan-2-ylbenzoyl)piperidin-3-yl]methoxy]benzamide
CID 92900980
N-cyclopropyl-3-[[1-[4-(trifluoromethyl)benzoyl]piperidin-3-yl]methoxy]benzamide
CID 50847037

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide?
The IUPAC name of N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide (CID 53150228) is N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide?
The canonical SMILES for N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide is COc1ccc(C(=O)N2CCCC(COc3ccc(C(=O)NC4CC4)cc3)C2)c(C)c1.
What is the InChIKey of N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide?
The InChIKey is OHVBZVJSZFULRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O4/c1-17-14-22(30-2)11-12-23(17)25(29)27-13-3-4-18(15-27)16-31-21-9-5-19(6-10-21)24(28)26-20-7-8-20/h5-6,9-12,14,18,20H,3-4,7-8,13,15-16H2,1-2H3,(H,26,28).
What are the key properties of N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide?
N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide has a molecular weight of 422.53 g/mol, XLogP of 3.83, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]benzamide is sourced from PubChem (CID 53150228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).