N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide

C17H25NO3 — CID 115495986

IUPACN-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide
SMILESCC(O)Cc1ccc(OC(C)C(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H25NO3/c1-12(19)11-14-7-9-16(10-8-14)21-13(2)17(20)18-15-5-3-4-6-15/h7-10,12-13,15,19H,3-6,11H2,1-2H3,(H,18,20)
InChIKeyYXBJNSFRMNAGGT-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.44
Rot. Bonds6

About N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide

N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide (PubChem CID 115495986) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide
PubChem CID115495986
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide
SMILESCC(O)Cc1ccc(OC(C)C(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H25NO3/c1-12(19)11-14-7-9-16(10-8-14)21-13(2)17(20)18-15-5-3-4-6-15/h7-10,12-13,15,19H,3-6,11H2,1-2H3,(H,18,20)
InChIKeyYXBJNSFRMNAGGT-UHFFFAOYSA-N
XLogP2.44
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-[4-(3-oxobutyl)phenoxy]propanamide
CID 78767064
N-cyclopropyl-2-(4-ethylphenoxy)propanamide
CID 60625156
N-cyclooctyl-2-(4-fluorophenoxy)propanamide
CID 42909316
(2R)-N-cycloheptyl-2-phenoxypropanamide
CID 669971
4-[1-(cyclohexylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 43084651
(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
CID 7868566
2-(4-tert-butylphenoxy)-N-cycloheptylpropanamide
CID 19203440
2-[4-[(1R)-1-aminopropyl]phenoxy]-N-cyclopentylpropanamide
CID 78930256
(2S)-N-cyclopentyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100702405
N-cyclopentyl-2-(4-methylsulfonylphenoxy)propanamide
CID 51174549
methyl 4-[1-(cyclohexylamino)-1-oxopropan-2-yl]oxybenzoate
CID 17462378
2-[4-(3-aminobutyl)phenoxy]-N-cyclopropylpropanamide
CID 43116380

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide?
The IUPAC name of N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide (CID 115495986) is N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide?
The canonical SMILES for N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide is CC(O)Cc1ccc(OC(C)C(=O)NC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide?
The InChIKey is YXBJNSFRMNAGGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-12(19)11-14-7-9-16(10-8-14)21-13(2)17(20)18-15-5-3-4-6-15/h7-10,12-13,15,19H,3-6,11H2,1-2H3,(H,18,20).
What are the key properties of N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide?
N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide has a molecular weight of 291.39 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide is sourced from PubChem (CID 115495986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).