2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide

C20H26N2O2 — CID 54845702

IUPAC2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CNC(CC)c2ccccc2)c1
InChIInChI=1S/C20H26N2O2/c1-3-13-24-18-12-8-11-17(14-18)22-20(23)15-21-19(4-2)16-9-6-5-7-10-16/h5-12,14,19,21H,3-4,13,15H2,1-2H3,(H,22,23)
InChIKeyDVONKZNEVRYODV-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.15
Rot. Bonds9

About 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide

2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide (PubChem CID 54845702) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide
PubChem CID54845702
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CNC(CC)c2ccccc2)c1
InChIInChI=1S/C20H26N2O2/c1-3-13-24-18-12-8-11-17(14-18)22-20(23)15-21-19(4-2)16-9-6-5-7-10-16/h5-12,14,19,21H,3-4,13,15H2,1-2H3,(H,22,23)
InChIKeyDVONKZNEVRYODV-UHFFFAOYSA-N
XLogP4.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-phenoxyethoxy)phenyl]-2-(1-phenylpropylamino)acetamide
CID 54845800
N-(1-phenylpropyl)-3-propoxyaniline
CID 43693763
2-(ethylamino)-N-(3-propoxyphenyl)acetamide
CID 54820704
N-(4-ethoxyphenyl)-2-(1-phenylpropylamino)acetamide
CID 54845214
2-[1-(3-chlorophenyl)propylamino]-N-phenylacetamide
CID 112841756
N,N-dimethyl-3-[[2-(1-phenylpropylamino)acetyl]amino]benzamide
CID 54845868
N-(3-hexoxyphenyl)-2-(propan-2-ylamino)acetamide
CID 54817631
N-[3-[[2-(3-propoxyanilino)acetyl]amino]phenyl]propanamide
CID 54825188
3-amino-2-methyl-3-phenyl-N-(3-propoxyphenyl)propanamide
CID 119715007
1-phenyl-N-[(3-propoxyphenyl)methyl]propan-1-amine
CID 54848596
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
2-(1-phenylpropylamino)-N-(4-prop-2-enoxyphenyl)acetamide
CID 54845474

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide (CID 54845702) is 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide is CCCOc1cccc(NC(=O)CNC(CC)c2ccccc2)c1.
What is the InChIKey of 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide?
The InChIKey is DVONKZNEVRYODV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-3-13-24-18-12-8-11-17(14-18)22-20(23)15-21-19(4-2)16-9-6-5-7-10-16/h5-12,14,19,21H,3-4,13,15H2,1-2H3,(H,22,23).
What are the key properties of 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide?
2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide has a molecular weight of 326.44 g/mol, XLogP of 4.15, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenylpropylamino)-N-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 54845702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).