(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide

C19H24N2O2 — CID 39943771

IUPAC(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide
SMILESC[C@@H](OCc1ccccc1)C(=O)NCc1ccc(N(C)C)cc1
InChIInChI=1S/C19H24N2O2/c1-15(23-14-17-7-5-4-6-8-17)19(22)20-13-16-9-11-18(12-10-16)21(2)3/h4-12,15H,13-14H2,1-3H3,(H,20,22)/t15-/m1/s1
InChIKeyRQJWVPXDWPDBCH-OAHLLOKOSA-N
MW312.41 g/mol
LogP2.97
Rot. Bonds7

About (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide

(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide (PubChem CID 39943771) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide.

Molecular Properties

Compound Name(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide
PubChem CID39943771
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide
SMILESC[C@@H](OCc1ccccc1)C(=O)NCc1ccc(N(C)C)cc1
InChIInChI=1S/C19H24N2O2/c1-15(23-14-17-7-5-4-6-8-17)19(22)20-13-16-9-11-18(12-10-16)21(2)3/h4-12,15H,13-14H2,1-3H3,(H,20,22)/t15-/m1/s1
InChIKeyRQJWVPXDWPDBCH-OAHLLOKOSA-N
XLogP2.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-ethoxypropanamide
CID 94797015
2-phenylmethoxy-N-(pyridin-3-ylmethyl)propanamide
CID 42959352
2-(2-chlorophenoxy)-N-[[4-(dimethylamino)phenyl]methyl]propanamide
CID 53282907
N-[[4-(dimethylamino)phenyl]methyl]-2-hydroxy-2-phenylacetamide
CID 110879983
N-[(3-bromo-4-methoxyphenyl)methyl]-2-phenylmethoxypropanamide
CID 60620947
N-[1-(benzylamino)-1-oxopropan-2-yl]-4-(dimethylamino)benzamide
CID 60571690
2-(4-chlorophenoxy)-N-[[4-(dimethylamino)phenyl]methyl]propanamide
CID 53282388
2-hydroxy-3-(2-phenylmethoxypropanoylamino)propanoic acid
CID 66166214
2-(carbamoylamino)-N-[[4-(dimethylamino)phenyl]methyl]-3-phenylpropanamide
CID 18164481
2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 47286046
2-amino-N-[[4-(dimethylamino)phenyl]methyl]-3-methylbutanamide
CID 61250496
2-amino-N-[[4-(dimethylamino)phenyl]methyl]-3-methoxypropanamide
CID 81088298

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide?
The IUPAC name of (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide (CID 39943771) is (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide.
What is the SMILES notation for (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide?
The canonical SMILES for (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide is C[C@@H](OCc1ccccc1)C(=O)NCc1ccc(N(C)C)cc1.
What is the InChIKey of (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide?
The InChIKey is RQJWVPXDWPDBCH-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15(23-14-17-7-5-4-6-8-17)19(22)20-13-16-9-11-18(12-10-16)21(2)3/h4-12,15H,13-14H2,1-3H3,(H,20,22)/t15-/m1/s1.
What are the key properties of (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide?
(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide has a molecular weight of 312.41 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide is sourced from PubChem (CID 39943771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).