N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide

C18H22N2O — CID 43275980

IUPACN-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)Cc1ccccc1)c1ccc(CN)cc1
InChIInChI=1S/C18H22N2O/c1-14(2)20(17-10-8-16(13-19)9-11-17)18(21)12-15-6-4-3-5-7-15/h3-11,14H,12-13,19H2,1-2H3
InChIKeyFBUQKKNQGUBGGT-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.13
Rot. Bonds5

About N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide

N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide (PubChem CID 43275980) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide
PubChem CID43275980
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)Cc1ccccc1)c1ccc(CN)cc1
InChIInChI=1S/C18H22N2O/c1-14(2)20(17-10-8-16(13-19)9-11-17)18(21)12-15-6-4-3-5-7-15/h3-11,14H,12-13,19H2,1-2H3
InChIKeyFBUQKKNQGUBGGT-UHFFFAOYSA-N
XLogP3.13
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(aminomethyl)phenyl]-N-methyl-2-phenylacetamide
CID 28755638
N-[4-(aminomethyl)phenyl]-N-propan-2-ylacetamide
CID 43275962
2-(N-(2-phenylacetyl)anilino)propanamide
CID 67696116
[2-oxo-2-(N-propan-2-ylanilino)ethyl] 2-phenylacetate
CID 2354919
N-[4-(aminomethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]-N-propan-2-ylacetamide
CID 115949136
N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide
CID 43275967
1-[4-(aminomethyl)phenyl]-1,3-di(propan-2-yl)urea
CID 43276091
N-[4-(aminomethyl)phenyl]-N-propan-2-ylpyridine-3-carboxamide
CID 43276007
2-[4-(aminomethyl)phenyl]-N-propan-2-yl-N-propylacetamide
CID 63588884
N-[4-(aminomethyl)phenyl]-2-cyclopropyl-N-propan-2-ylpropanamide
CID 83146456
N-[4-(aminomethyl)phenyl]-5-methyl-N-propan-2-ylfuran-3-carboxamide
CID 114818480
N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide
CID 174490101

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide (CID 43275980) is N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide is CC(C)N(C(=O)Cc1ccccc1)c1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide?
The InChIKey is FBUQKKNQGUBGGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-14(2)20(17-10-8-16(13-19)9-11-17)18(21)12-15-6-4-3-5-7-15/h3-11,14H,12-13,19H2,1-2H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide?
N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide has a molecular weight of 282.39 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 43275980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).