N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide

C14H22N2O2 — CID 61057989

IUPACN-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide
SMILESCNC(=O)C(C)NCc1ccc(OC(C)C)cc1
InChIInChI=1S/C14H22N2O2/c1-10(2)18-13-7-5-12(6-8-13)9-16-11(3)14(17)15-4/h5-8,10-11,16H,9H2,1-4H3,(H,15,17)
InChIKeyUEWCXEHDNFIYRU-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.70
Rot. Bonds6

About N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide

N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide (PubChem CID 61057989) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide
PubChem CID61057989
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide
SMILESCNC(=O)C(C)NCc1ccc(OC(C)C)cc1
InChIInChI=1S/C14H22N2O2/c1-10(2)18-13-7-5-12(6-8-13)9-16-11(3)14(17)15-4/h5-8,10-11,16H,9H2,1-4H3,(H,15,17)
InChIKeyUEWCXEHDNFIYRU-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-[(4-propan-2-yloxyphenyl)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

methyl 2-[(4-propan-2-yloxyphenyl)methylamino]propanoate
CID 60781966
4-[[[1-(methylamino)-1-oxopropan-2-yl]amino]methyl]benzamide
CID 60674315
N-(furan-2-ylmethyl)-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide
CID 119128983
(2R)-2-[(4-cyanophenyl)methylamino]-N-methylpropanamide
CID 93355745
2-[(4-cyanophenyl)methylamino]-N-methylpropanamide
CID 60918903
2-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-N-methylpropanamide
CID 10064347
2-amino-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 115152374
1-propan-2-yl-3-[(4-propan-2-yloxyphenyl)methyl]urea
CID 47216205
2-[(3,4-dimethoxyphenyl)methylamino]-N-methylpropanamide
CID 43400841
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]-N-methylpropanamide
CID 10193260
2-[(3,4-difluorophenyl)methylamino]-N-methylpropanamide
CID 61057983
(2S)-N-[(4-propan-2-yloxyphenyl)methyl]butan-2-amine
CID 39245142

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide?
The IUPAC name of N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide (CID 61057989) is N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide.
What is the SMILES notation for N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide?
The canonical SMILES for N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide is CNC(=O)C(C)NCc1ccc(OC(C)C)cc1.
What is the InChIKey of N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide?
The InChIKey is UEWCXEHDNFIYRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10(2)18-13-7-5-12(6-8-13)9-16-11(3)14(17)15-4/h5-8,10-11,16H,9H2,1-4H3,(H,15,17).
What are the key properties of N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide?
N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide has a molecular weight of 250.34 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide is sourced from PubChem (CID 61057989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).