N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide

C19H21NO — CID 25381115

IUPACN-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide
SMILESC[C@H](NC(=O)C1CCC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H21NO/c1-14(20-19(21)18-8-5-9-18)15-10-12-17(13-11-15)16-6-3-2-4-7-16/h2-4,6-7,10-14,18H,5,8-9H2,1H3,(H,20,21)/t14-/m0/s1
InChIKeyUICMBGLNHKOBIS-AWEZNQCLSA-N
MW279.38 g/mol
LogP4.33
Rot. Bonds4

About N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide

N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide (PubChem CID 25381115) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide
PubChem CID25381115
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide
SMILESC[C@H](NC(=O)C1CCC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H21NO/c1-14(20-19(21)18-8-5-9-18)15-10-12-17(13-11-15)16-6-3-2-4-7-16/h2-4,6-7,10-14,18H,5,8-9H2,1H3,(H,20,21)/t14-/m0/s1
InChIKeyUICMBGLNHKOBIS-AWEZNQCLSA-N
XLogP4.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,4-N-bis[(1S)-1-phenylethyl]cyclohexane-1,4-dicarboxamide
CID 40636599
N-[1-(4-phenylphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119685570
N-[(1S)-1-(4-bromophenyl)ethyl]cyclobutanecarboxamide
CID 800129
(3S)-1-N-phenyl-3-N-[(1S)-1-(4-phenylphenyl)ethyl]piperidine-1,3-dicarboxamide
CID 41073570
N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]cyclobutanecarboxamide
CID 34483284
2-N-[1-(4-phenylphenyl)ethyl]cyclobutane-1,2-dicarboxamide
CID 167814895
N-(1-phenylethyl)piperidine-4-carboxamide
CID 2903820
N-[1-(4-fluorophenyl)ethyl]cyclohexanecarboxamide
CID 46763137
N-[1-(4-ethoxyphenyl)ethyl]cyclobutanecarboxamide
CID 2918368
N-(1-phenylethyl)piperidine-3-carboxamide
CID 18071982
3-amino-N-[1-(4-pyridin-4-ylphenyl)ethyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119895790
N-[1-[4-(2-methylpropyl)phenyl]ethyl]cyclopentanecarboxamide
CID 112791720

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide?
The IUPAC name of N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide (CID 25381115) is N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide?
The canonical SMILES for N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide is C[C@H](NC(=O)C1CCC1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide?
The InChIKey is UICMBGLNHKOBIS-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H21NO/c1-14(20-19(21)18-8-5-9-18)15-10-12-17(13-11-15)16-6-3-2-4-7-16/h2-4,6-7,10-14,18H,5,8-9H2,1H3,(H,20,21)/t14-/m0/s1.
What are the key properties of N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide?
N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide has a molecular weight of 279.38 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-phenylphenyl)ethyl]cyclobutanecarboxamide is sourced from PubChem (CID 25381115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).