1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide

C20H28N2O3 — CID 95183567

IUPAC1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide
SMILESCC1(C(=O)NC[C@H](C(=O)N2CCOCC2)c2ccccc2)CCCC1
InChIInChI=1S/C20H28N2O3/c1-20(9-5-6-10-20)19(24)21-15-17(16-7-3-2-4-8-16)18(23)22-11-13-25-14-12-22/h2-4,7-8,17H,5-6,9-15H2,1H3,(H,21,24)/t17-/m0/s1
InChIKeyHBYZXMDERSZGNX-KRWDZBQOSA-N
MW344.46 g/mol
LogP2.33
Rot. Bonds5

About 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide

1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide (PubChem CID 95183567) has the molecular formula C20H28N2O3 and a molecular weight of 344.46 g/mol. Its IUPAC name is 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide
PubChem CID95183567
Molecular FormulaC20H28N2O3
Molecular Weight344.46 g/mol
Exact Mass344.21
IUPAC Name1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide
SMILESCC1(C(=O)NC[C@H](C(=O)N2CCOCC2)c2ccccc2)CCCC1
InChIInChI=1S/C20H28N2O3/c1-20(9-5-6-10-20)19(24)21-15-17(16-7-3-2-4-8-16)18(23)22-11-13-25-14-12-22/h2-4,7-8,17H,5-6,9-15H2,1H3,(H,21,24)/t17-/m0/s1
InChIKeyHBYZXMDERSZGNX-KRWDZBQOSA-N
XLogP2.33
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)-3-(1-phenylcyclobutyl)urea
CID 86888650
(2S)-1-morpholin-4-yl-2-phenylbutan-1-one
CID 670056
3-[(2-methyloxolan-3-yl)amino]-1-morpholin-4-yl-2-phenylpropan-1-one
CID 75441504
N-(2-amino-2-phenylethyl)-1-methylcyclopentane-1-carboxamide;hydrochloride
CID 119529565
1-morpholin-4-yl-2-phenyl-3-[(4-propan-2-ylphenyl)methylamino]propan-1-one
CID 86893294
N-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)-4-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 86886437
1-butyl-2-methyl-3-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)guanidine
CID 111150938
1-(3-methyl-3-phenylbutan-2-yl)-3-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)urea
CID 86886974
3-[(3-methylpyrrolidine-3-carbonyl)amino]-2-phenylpropanoic acid
CID 63142311
2-(2,2-dimethylpropyl)-N-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)pyrrolidine-1-carboxamide
CID 86886423
2-methyl-1-(3-methylbutyl)-3-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)guanidine;hydroiodide
CID 110978954
1-benzyl-1,2-dimethyl-3-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)guanidine;hydroiodide
CID 110951665

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide (CID 95183567) is 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide is CC1(C(=O)NC[C@H](C(=O)N2CCOCC2)c2ccccc2)CCCC1.
What is the InChIKey of 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide?
The InChIKey is HBYZXMDERSZGNX-KRWDZBQOSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-20(9-5-6-10-20)19(24)21-15-17(16-7-3-2-4-8-16)18(23)22-11-13-25-14-12-22/h2-4,7-8,17H,5-6,9-15H2,1H3,(H,21,24)/t17-/m0/s1.
What are the key properties of 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide?
1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide has a molecular weight of 344.46 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(2R)-3-morpholin-4-yl-3-oxo-2-phenylpropyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 95183567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).