N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide

C22H27N3O2 — CID 173174698

IUPACN-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide
SMILESCN(CC1(c2ccc(NC(=O)Cc3ccccc3)cc2)CCCC1)C(N)=O
InChIInChI=1S/C22H27N3O2/c1-25(21(23)27)16-22(13-5-6-14-22)18-9-11-19(12-10-18)24-20(26)15-17-7-3-2-4-8-17/h2-4,7-12H,5-6,13-16H2,1H3,(H2,23,27)(H,24,26)
InChIKeyQFRPQHYLQINXJF-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.69
Rot. Bonds6

About N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide

N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide (PubChem CID 173174698) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide
PubChem CID173174698
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide
SMILESCN(CC1(c2ccc(NC(=O)Cc3ccccc3)cc2)CCCC1)C(N)=O
InChIInChI=1S/C22H27N3O2/c1-25(21(23)27)16-22(13-5-6-14-22)18-9-11-19(12-10-18)24-20(26)15-17-7-3-2-4-8-17/h2-4,7-12H,5-6,13-16H2,1H3,(H2,23,27)(H,24,26)
InChIKeyQFRPQHYLQINXJF-UHFFFAOYSA-N
XLogP3.69
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide
CID 173174709
N-[4-(dimethylamino)phenyl]-2-phenylacetamide
CID 4095589
N-[4-[(2-phenylacetyl)amino]phenyl]propanamide
CID 1274275
N,N-dimethyl-1-(1-phenylcyclopentyl)methanamine
CID 646439
1-methyl-3-[4-[(S)-methylsulfinyl]phenyl]-1-[(1-phenylcyclopropyl)methyl]urea
CID 99830156
N-[4-[4-(dimethylamino)anilino]phenyl]-2-phenylacetamide
CID 112988673
N-(4-ethylphenyl)-2-phenylacetamide
CID 2684383
ethane;2-phenyl-N-[4-[[4-[(2-phenylacetyl)amino]phenyl]methyl]phenyl]acetamide
CID 123587423
N-[4-[(1R)-1-hydroxyethyl]phenyl]-2-phenylacetamide
CID 93090514
N-methyl-N-[[1-(4-methylphenyl)cyclopentyl]methyl]acetamide
CID 59019943
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
N-[4-(tert-butylamino)phenyl]-2-phenylacetamide
CID 112984887

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide?
The IUPAC name of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide (CID 173174698) is N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide.
What is the SMILES notation for N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide?
The canonical SMILES for N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide is CN(CC1(c2ccc(NC(=O)Cc3ccccc3)cc2)CCCC1)C(N)=O.
What is the InChIKey of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide?
The InChIKey is QFRPQHYLQINXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-25(21(23)27)16-22(13-5-6-14-22)18-9-11-19(12-10-18)24-20(26)15-17-7-3-2-4-8-17/h2-4,7-12H,5-6,13-16H2,1H3,(H2,23,27)(H,24,26).
What are the key properties of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide?
N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide has a molecular weight of 365.48 g/mol, XLogP of 3.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide is sourced from PubChem (CID 173174698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).