N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine

C18H25N — CID 65305418

IUPACN-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine
SMILESCCNCCCCCc1ccc(C)c2ccccc12
InChIInChI=1S/C18H25N/c1-3-19-14-8-4-5-9-16-13-12-15(2)17-10-6-7-11-18(16)17/h6-7,10-13,19H,3-5,8-9,14H2,1-2H3
InChIKeyHWTADKWXJSESEQ-UHFFFAOYSA-N
MW255.41 g/mol
LogP4.47
Rot. Bonds7

About N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine

N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine (PubChem CID 65305418) has the molecular formula C18H25N and a molecular weight of 255.41 g/mol. Its IUPAC name is N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine
PubChem CID65305418
Molecular FormulaC18H25N
Molecular Weight255.41 g/mol
Exact Mass255.20
IUPAC NameN-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine
SMILESCCNCCCCCc1ccc(C)c2ccccc12
InChIInChI=1S/C18H25N/c1-3-19-14-8-4-5-9-16-13-12-15(2)17-10-6-7-11-18(16)17/h6-7,10-13,19H,3-5,8-9,14H2,1-2H3
InChIKeyHWTADKWXJSESEQ-UHFFFAOYSA-N
XLogP4.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-6-(4-fluoronaphthalen-1-yl)hexan-1-amine
CID 65306558
4-(4-chloronaphthalen-1-yl)-N-ethylbutan-1-amine
CID 79597058
5-(4-methylnaphthalen-1-yl)pentan-1-amine
CID 65305159
N-ethyl-3,3-dimethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine
CID 65304338
3-(4-methylnaphthalen-1-yl)propan-1-amine
CID 55266988
6-(4-chloronaphthalen-1-yl)-N-propylhexan-1-amine
CID 79593269
1-hexyl-4-propylnaphthalene
CID 173269452
N-ethyl-17-phenylheptadecan-1-amine
CID 139804977
N,N-dimethyl-3-(4-methylnaphthalen-1-yl)propan-1-amine
CID 170865366
1-heptyl-4-[3-(4-heptylnaphthalen-1-yl)propyl]naphthalene
CID 157140020
5-(4-chloronaphthalen-1-yl)-N-(2-methoxyethyl)pentan-1-amine
CID 79593271
5-(4-chloro-2,5-dimethylphenyl)-N-ethylpentan-1-amine
CID 65305563

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine?
The IUPAC name of N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine (CID 65305418) is N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine.
What is the SMILES notation for N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine?
The canonical SMILES for N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine is CCNCCCCCc1ccc(C)c2ccccc12.
What is the InChIKey of N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine?
The InChIKey is HWTADKWXJSESEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N/c1-3-19-14-8-4-5-9-16-13-12-15(2)17-10-6-7-11-18(16)17/h6-7,10-13,19H,3-5,8-9,14H2,1-2H3.
What are the key properties of N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine?
N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine has a molecular weight of 255.41 g/mol, XLogP of 4.47, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(4-methylnaphthalen-1-yl)pentan-1-amine is sourced from PubChem (CID 65305418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).