N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide

C15H24N2O2 — CID 115153227

IUPACN-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide
SMILESCNCCC(=O)NCc1cc(C(C)C)ccc1OC
InChIInChI=1S/C15H24N2O2/c1-11(2)12-5-6-14(19-4)13(9-12)10-17-15(18)7-8-16-3/h5-6,9,11,16H,7-8,10H2,1-4H3,(H,17,18)
InChIKeyHWCKIQOOSPPAQO-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.04
Rot. Bonds7

About N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide

N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide (PubChem CID 115153227) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide
PubChem CID115153227
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide
SMILESCNCCC(=O)NCc1cc(C(C)C)ccc1OC
InChIInChI=1S/C15H24N2O2/c1-11(2)12-5-6-14(19-4)13(9-12)10-17-15(18)7-8-16-3/h5-6,9,11,16H,7-8,10H2,1-4H3,(H,17,18)
InChIKeyHWCKIQOOSPPAQO-UHFFFAOYSA-N
XLogP2.04
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-sulfanylpropanamide
CID 115167836
2-hydroxy-N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
CID 94687136
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-2-sulfanylacetamide
CID 115167149
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
CID 110780628
4-[(2-methoxy-5-propan-2-ylphenyl)methylamino]butan-2-one
CID 115235635
N-[(2,5-dimethoxyphenyl)methyl]-4-(methylamino)butanamide
CID 61252269
4-[(2-methoxy-5-propan-2-ylphenyl)methylamino]butanoic acid
CID 115218601
methyl 5-(2-methoxy-5-propan-2-ylphenyl)-3-oxopentanoate
CID 54410073
N-cyclopentyl-2-(2-methoxy-5-propan-2-ylphenyl)acetamide
CID 110767613
2-(2-methoxy-5-propan-2-ylphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110767628
2-amino-3-[(2-methoxy-5-propan-2-ylphenyl)methylamino]propanoic acid
CID 115240663
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-1,3-benzodioxole-5-carboxamide
CID 110793620

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide?
The IUPAC name of N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide (CID 115153227) is N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide.
What is the SMILES notation for N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide?
The canonical SMILES for N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide is CNCCC(=O)NCc1cc(C(C)C)ccc1OC.
What is the InChIKey of N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide?
The InChIKey is HWCKIQOOSPPAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)12-5-6-14(19-4)13(9-12)10-17-15(18)7-8-16-3/h5-6,9,11,16H,7-8,10H2,1-4H3,(H,17,18).
What are the key properties of N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide?
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide has a molecular weight of 264.37 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-5-propan-2-ylphenyl)methyl]-3-(methylamino)propanamide is sourced from PubChem (CID 115153227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).