N-methyl-1-naphthalen-2-ylhexan-1-amine

C17H23N — CID 63416228

IUPACN-methyl-1-naphthalen-2-ylhexan-1-amine
SMILESCCCCCC(NC)c1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-3-4-5-10-17(18-2)16-12-11-14-8-6-7-9-15(14)13-16/h6-9,11-13,17-18H,3-5,10H2,1-2H3
InChIKeyXEGFOQPFQDSZGX-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.68
Rot. Bonds6

About N-methyl-1-naphthalen-2-ylhexan-1-amine

N-methyl-1-naphthalen-2-ylhexan-1-amine (PubChem CID 63416228) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is N-methyl-1-naphthalen-2-ylhexan-1-amine.

Molecular Properties

Compound NameN-methyl-1-naphthalen-2-ylhexan-1-amine
PubChem CID63416228
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC NameN-methyl-1-naphthalen-2-ylhexan-1-amine
SMILESCCCCCC(NC)c1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-3-4-5-10-17(18-2)16-12-11-14-8-6-7-9-15(14)13-16/h6-9,11-13,17-18H,3-5,10H2,1-2H3
InChIKeyXEGFOQPFQDSZGX-UHFFFAOYSA-N
XLogP4.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 54.68
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

1-naphthalen-2-ylnonylhydrazine
CID 105213332
1-(6-bromonaphthalen-2-yl)-N-methylheptan-1-amine
CID 115833804
3-ethoxy-N-methyl-1-naphthalen-2-ylpropan-1-amine
CID 112688302
2-octan-3-ylnaphthalene
CID 14029920
N-methyl-1-naphthalen-2-yl-2-propylsulfonylethanamine
CID 64644731
1-(3-methoxyphenyl)-N-methyloctan-1-amine
CID 62606041
1-(3,4-diethylphenyl)-N-methylnonan-1-amine
CID 115482264
N,3-dimethyl-1-naphthalen-2-ylpentan-1-amine
CID 62716073
N-methyl-1-(3-methylphenyl)decan-1-amine
CID 55186614
N-methyl-1-(4-methylphenyl)hexan-1-amine
CID 43481744
1-(3-ethoxyphenyl)-N-methyloctan-1-amine
CID 63414282
1-(3-ethoxyphenyl)-N-methylnonan-1-amine
CID 63414326

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-naphthalen-2-ylhexan-1-amine?
The IUPAC name of N-methyl-1-naphthalen-2-ylhexan-1-amine (CID 63416228) is N-methyl-1-naphthalen-2-ylhexan-1-amine.
What is the SMILES notation for N-methyl-1-naphthalen-2-ylhexan-1-amine?
The canonical SMILES for N-methyl-1-naphthalen-2-ylhexan-1-amine is CCCCCC(NC)c1ccc2ccccc2c1.
What is the InChIKey of N-methyl-1-naphthalen-2-ylhexan-1-amine?
The InChIKey is XEGFOQPFQDSZGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-3-4-5-10-17(18-2)16-12-11-14-8-6-7-9-15(14)13-16/h6-9,11-13,17-18H,3-5,10H2,1-2H3.
What are the key properties of N-methyl-1-naphthalen-2-ylhexan-1-amine?
N-methyl-1-naphthalen-2-ylhexan-1-amine has a molecular weight of 241.38 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-naphthalen-2-ylhexan-1-amine is sourced from PubChem (CID 63416228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).