3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine

C17H23N — CID 54950144

IUPAC3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine
SMILESCCC(C)C(C)NCc1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-4-13(2)14(3)18-12-15-9-10-16-7-5-6-8-17(16)11-15/h5-11,13-14,18H,4,12H2,1-3H3
InChIKeyMOARZNVKNRRZRJ-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.36
Rot. Bonds5

About 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine

3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine (PubChem CID 54950144) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine.

Molecular Properties

Compound Name3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine
PubChem CID54950144
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine
SMILESCCC(C)C(C)NCc1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-4-13(2)14(3)18-12-15-9-10-16-7-5-6-8-17(16)11-15/h5-11,13-14,18H,4,12H2,1-3H3
InChIKeyMOARZNVKNRRZRJ-UHFFFAOYSA-N
XLogP4.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-N-(naphthalen-2-ylmethyl)pentan-2-amine
CID 63843096
3-methyl-N-(naphthalen-2-ylmethyl)butan-2-amine
CID 43085087
(2S,3R)-N-benzyl-3-methylpentan-2-amine
CID 28611871
(2S,3S)-N-benzyl-3-methylpentan-2-amine
CID 28611874
(2R,3R)-N-benzyl-3-methylpentan-2-amine
CID 28611865
3-methyl-N-[(2-methylquinolin-6-yl)methyl]pentan-2-amine
CID 105378393
(1R,2S)-2-(naphthalen-2-ylmethylamino)-1-phenylpropan-1-ol
CID 101460872
methyl 2-(naphthalen-2-ylmethylamino)propanoate
CID 60691147
3-methyl-N-[(3-phenoxyphenyl)methyl]pentan-2-amine
CID 63456005
N-(naphthalen-2-ylmethyl)hexan-3-amine
CID 63477604
1-methoxy-3-methyl-N-(naphthalen-2-ylmethyl)butan-2-amine
CID 65047641
1-methylsulfanyl-N-(naphthalen-2-ylmethyl)propan-2-amine
CID 113239115

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine?
The IUPAC name of 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine (CID 54950144) is 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine.
What is the SMILES notation for 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine?
The canonical SMILES for 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine is CCC(C)C(C)NCc1ccc2ccccc2c1.
What is the InChIKey of 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine?
The InChIKey is MOARZNVKNRRZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-4-13(2)14(3)18-12-15-9-10-16-7-5-6-8-17(16)11-15/h5-11,13-14,18H,4,12H2,1-3H3.
What are the key properties of 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine?
3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine has a molecular weight of 241.38 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(naphthalen-2-ylmethyl)pentan-2-amine is sourced from PubChem (CID 54950144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).