N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide

C17H25NO3 — CID 110001954

IUPACN-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCC1(C(=O)N[C@H](CO)c2ccccc2)CCCC1
InChIInChI=1S/C17H25NO3/c1-21-12-11-17(9-5-6-10-17)16(20)18-15(13-19)14-7-3-2-4-8-14/h2-4,7-8,15,19H,5-6,9-13H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyQFCXNFZMTLHRDE-OAHLLOKOSA-N
MW291.39 g/mol
LogP2.43
Rot. Bonds7

About N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide

N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide (PubChem CID 110001954) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide
PubChem CID110001954
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCC1(C(=O)N[C@H](CO)c2ccccc2)CCCC1
InChIInChI=1S/C17H25NO3/c1-21-12-11-17(9-5-6-10-17)16(20)18-15(13-19)14-7-3-2-4-8-14/h2-4,7-8,15,19H,5-6,9-13H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyQFCXNFZMTLHRDE-OAHLLOKOSA-N
XLogP2.43
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-2-hydroxy-1-phenylethyl]-3-propylpiperidine-3-carboxamide
CID 107863291
N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 120597733
1-amino-N-[(1R)-2-hydroxy-1-phenylethyl]cyclobutane-1-carboxamide
CID 114010313
1-(hydroxymethylamino)-N-[(1S)-2-hydroxy-1-phenylethyl]cyclohexane-1-carboxamide
CID 143504731
N-[(1R)-2-hydroxy-1-phenylethyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
CID 50984628
N-[(1R)-2-hydroxy-1-phenylethyl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 107863282
N-[(1S)-2-hydroxy-1-phenylethyl]-5-methoxypentanamide
CID 110001835
methyl 4-[(2-hydroxy-1-phenylethyl)carbamoyl]cubane-1-carboxylate
CID 166595064
1-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-(2-methoxy-1-phenylethyl)urea
CID 111618774
N-(2-hydroxy-1-phenylethyl)-2-(methoxymethyl)benzamide
CID 63182538
4-amino-N-[(1R)-2-hydroxy-1-phenylethyl]oxane-4-carboxamide
CID 103951352
2-(2-methoxyethylamino)-2-phenylethanol
CID 62544769

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
The IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide (CID 110001954) is N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide is COCCC1(C(=O)N[C@H](CO)c2ccccc2)CCCC1.
What is the InChIKey of N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
The InChIKey is QFCXNFZMTLHRDE-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H25NO3/c1-21-12-11-17(9-5-6-10-17)16(20)18-15(13-19)14-7-3-2-4-8-14/h2-4,7-8,15,19H,5-6,9-13H2,1H3,(H,18,20)/t15-/m1/s1.
What are the key properties of N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide has a molecular weight of 291.39 g/mol, XLogP of 2.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 110001954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).