(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide

C22H28N2O3 — CID 125164955

IUPAC(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide
SMILESC[C@H](CCC(=O)NCc1cccc(Oc2ccccc2)c1)N1CCOCC1
InChIInChI=1S/C22H28N2O3/c1-18(24-12-14-26-15-13-24)10-11-22(25)23-17-19-6-5-9-21(16-19)27-20-7-3-2-4-8-20/h2-9,16,18H,10-15,17H2,1H3,(H,23,25)/t18-/m1/s1
InChIKeyGRZGZWZYRZETNI-GOSISDBHSA-N
MW368.48 g/mol
LogP3.60
Rot. Bonds8

About (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide

(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide (PubChem CID 125164955) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide.

Molecular Properties

Compound Name(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide
PubChem CID125164955
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide
SMILESC[C@H](CCC(=O)NCc1cccc(Oc2ccccc2)c1)N1CCOCC1
InChIInChI=1S/C22H28N2O3/c1-18(24-12-14-26-15-13-24)10-11-22(25)23-17-19-6-5-9-21(16-19)27-20-7-3-2-4-8-20/h2-9,16,18H,10-15,17H2,1H3,(H,23,25)/t18-/m1/s1
InChIKeyGRZGZWZYRZETNI-GOSISDBHSA-N
XLogP3.60
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-4-morpholin-4-yl-N-[[3-(2H-tetrazol-5-yl)phenyl]methyl]pentanamide
CID 125179870
(4S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-4-morpholin-4-ylpentanamide
CID 124753245
5-morpholin-4-ylsulfonyl-N-[(3-phenoxyphenyl)methyl]furan-2-carboxamide
CID 39576917
N-(2-morpholin-4-ylethyl)-2-[(3-phenoxyphenyl)methylsulfamoylamino]propanamide
CID 57391402
N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide
CID 58543320
2-methyl-1-(2-morpholin-4-ylethyl)-3-[(3-phenoxyphenyl)methyl]guanidine
CID 111069368
N-[(3-methoxyphenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 27231712
(2S)-3-methyl-2-[(3-phenoxyphenyl)methylamino]butanoic acid
CID 120510625
3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-[(3-phenoxyphenyl)methyl]propanamide
CID 55688806
N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenoxypropanamide
CID 75814355
N-[2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide
CID 16811467
N-ethyl-2-[(3-phenoxyphenyl)methylamino]acetamide
CID 43398912

Frequently Asked Questions

What is the IUPAC name of (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide?
The IUPAC name of (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide (CID 125164955) is (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide.
What is the SMILES notation for (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide?
The canonical SMILES for (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide is C[C@H](CCC(=O)NCc1cccc(Oc2ccccc2)c1)N1CCOCC1.
What is the InChIKey of (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide?
The InChIKey is GRZGZWZYRZETNI-GOSISDBHSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-18(24-12-14-26-15-13-24)10-11-22(25)23-17-19-6-5-9-21(16-19)27-20-7-3-2-4-8-20/h2-9,16,18H,10-15,17H2,1H3,(H,23,25)/t18-/m1/s1.
What are the key properties of (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide?
(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide has a molecular weight of 368.48 g/mol, XLogP of 3.60, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide is sourced from PubChem (CID 125164955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).