3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide

C23H26N2O2 — CID 157147686

IUPAC3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide
SMILESCC(C)OCc1cccc(C(CN)C(=O)Nc2ccc3ccccc3c2)c1
InChIInChI=1S/C23H26N2O2/c1-16(2)27-15-17-6-5-9-20(12-17)22(14-24)23(26)25-21-11-10-18-7-3-4-8-19(18)13-21/h3-13,16,22H,14-15,24H2,1-2H3,(H,25,26)
InChIKeyXCMFUHOVOJFKRG-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.45
Rot. Bonds7

About 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide

3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide (PubChem CID 157147686) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide.

Molecular Properties

Compound Name3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide
PubChem CID157147686
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC Name3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide
SMILESCC(C)OCc1cccc(C(CN)C(=O)Nc2ccc3ccccc3c2)c1
InChIInChI=1S/C23H26N2O2/c1-16(2)27-15-17-6-5-9-20(12-17)22(14-24)23(26)25-21-11-10-18-7-3-4-8-19(18)13-21/h3-13,16,22H,14-15,24H2,1-2H3,(H,25,26)
InChIKeyXCMFUHOVOJFKRG-UHFFFAOYSA-N
XLogP4.45
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]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

2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride
CID 119306292
(2R)-2-amino-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 119306295
2-amino-3-methoxy-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 120987551
(2R)-2-amino-3-methyl-N-naphthalen-2-ylbutanamide
CID 671224
3-amino-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 119306277
2-(benzylamino)-N-naphthalen-2-ylpropanamide
CID 4870007
3-[3-[3-amino-1-(isoquinolin-6-ylamino)-1-oxopropan-2-yl]phenyl]propylboronic acid
CID 174027234
3-amino-N-isoquinolin-6-yl-2-(4-phenylmethoxyphenyl)propanamide
CID 127030602
2-amino-3-methyl-N-[3-(propan-2-yloxymethyl)phenyl]pentanamide
CID 119753959
benzyl 3-[(3-amino-2-phenylpropanoyl)amino]benzoate
CID 57156076
[3-[3-amino-1-(isoquinolin-6-ylamino)-1-oxopropan-2-yl]phenyl] benzoate
CID 59563763
[(2S)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] (2S)-2-hydroxy-2-phenylacetate
CID 7821829

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide?
The IUPAC name of 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide (CID 157147686) is 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide.
What is the SMILES notation for 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide?
The canonical SMILES for 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide is CC(C)OCc1cccc(C(CN)C(=O)Nc2ccc3ccccc3c2)c1.
What is the InChIKey of 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide?
The InChIKey is XCMFUHOVOJFKRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-16(2)27-15-17-6-5-9-20(12-17)22(14-24)23(26)25-21-11-10-18-7-3-4-8-19(18)13-21/h3-13,16,22H,14-15,24H2,1-2H3,(H,25,26).
What are the key properties of 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide?
3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide has a molecular weight of 362.47 g/mol, XLogP of 4.45, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide is sourced from PubChem (CID 157147686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).