(2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one

C16H19NO — CID 142921923

IUPAC(2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one
SMILESCCC(=O)[C@@H](Cc1cccc2ccccc12)NC
InChIInChI=1S/C16H19NO/c1-3-16(18)15(17-2)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10,15,17H,3,11H2,1-2H3/t15-/m1/s1
InChIKeyYTVWIHDERYJJBH-OAHLLOKOSA-N
MW241.33 g/mol
LogP2.95
Rot. Bonds5

About (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one

(2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one (PubChem CID 142921923) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one.

Molecular Properties

Compound Name(2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one
PubChem CID142921923
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name(2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one
SMILESCCC(=O)[C@@H](Cc1cccc2ccccc12)NC
InChIInChI=1S/C16H19NO/c1-3-16(18)15(17-2)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10,15,17H,3,11H2,1-2H3/t15-/m1/s1
InChIKeyYTVWIHDERYJJBH-OAHLLOKOSA-N
XLogP2.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one 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

CID 59117847
CID 59117847
CID 59117842
CID 59117842
(2R)-N-methyl-1-naphthalen-1-ylpropan-2-amine
CID 142942326
(2S)-3-naphthalen-1-yl-2-(naphthalen-1-ylmethylamino)propanoic acid
CID 18728959
(2S)-3-naphthalen-1-yl-2-(propylsulfonylamino)propanoic acid
CID 67206691
2-formamido-3-naphthalen-1-ylpropanoic acid
CID 23093218
(2S)-2-[[(E)-hex-3-enoyl]amino]-3-naphthalen-1-ylpropanoic acid
CID 68734078
3-methyl-1-naphthalen-1-ylbutan-2-one
CID 12922161
N-[2-(dimethylamino)ethyl]-2-methyl-3-naphthalen-1-ylpropanamide
CID 18917772
1-naphthalen-1-ylbutan-2-one
CID 4564544
2-(hexadecanoylamino)-3-naphthalen-1-ylpropanoic acid
CID 23093240
methyl (2S)-2-amino-3-naphthalen-1-ylpropanoate
CID 18714238

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one?
The IUPAC name of (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one (CID 142921923) is (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one.
What is the SMILES notation for (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one?
The canonical SMILES for (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one is CCC(=O)[C@@H](Cc1cccc2ccccc12)NC.
What is the InChIKey of (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one?
The InChIKey is YTVWIHDERYJJBH-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-16(18)15(17-2)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10,15,17H,3,11H2,1-2H3/t15-/m1/s1.
What are the key properties of (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one?
(2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one has a molecular weight of 241.33 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(methylamino)-1-naphthalen-1-ylpentan-3-one is sourced from PubChem (CID 142921923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).