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

C20H23N3O2 — CID 173174709

IUPACN-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide
SMILESCN(CC1(c2ccc(NC(=O)Cc3ccccc3)cc2)CC1)C(N)=O
InChIInChI=1S/C20H23N3O2/c1-23(19(21)25)14-20(11-12-20)16-7-9-17(10-8-16)22-18(24)13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H2,21,25)(H,22,24)
InChIKeyRKDKNAQFECDGED-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.91
Rot. Bonds6

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

N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide (PubChem CID 173174709) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide
PubChem CID173174709
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide
SMILESCN(CC1(c2ccc(NC(=O)Cc3ccccc3)cc2)CC1)C(N)=O
InChIInChI=1S/C20H23N3O2/c1-23(19(21)25)14-20(11-12-20)16-7-9-17(10-8-16)22-18(24)13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H2,21,25)(H,22,24)
InChIKeyRKDKNAQFECDGED-UHFFFAOYSA-N
XLogP2.91
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide
CID 173174698
N-[4-(dimethylamino)phenyl]-2-phenylacetamide
CID 4095589
1-methyl-3-[4-[(S)-methylsulfinyl]phenyl]-1-[(1-phenylcyclopropyl)methyl]urea
CID 99830156
N-[4-[(2-phenylacetyl)amino]phenyl]propanamide
CID 1274275
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
(2S)-2-amino-N-[[1-(4-bromophenyl)cyclopropyl]methyl]-N-methyl-3-phenylpropanamide
CID 119333582
2-chloro-N-methyl-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 166414654
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]cyclopropyl]phenyl]-2-phenylacetamide?
The IUPAC name of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide (CID 173174709) is N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide.
What is the SMILES notation for N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide?
The canonical SMILES for N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide is CN(CC1(c2ccc(NC(=O)Cc3ccccc3)cc2)CC1)C(N)=O.
What is the InChIKey of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide?
The InChIKey is RKDKNAQFECDGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-23(19(21)25)14-20(11-12-20)16-7-9-17(10-8-16)22-18(24)13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H2,21,25)(H,22,24).
What are the key properties of N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide?
N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopropyl]phenyl]-2-phenylacetamide has a molecular weight of 337.42 g/mol, XLogP of 2.91, 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]cyclopropyl]phenyl]-2-phenylacetamide is sourced from PubChem (CID 173174709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).