N-methyl-1-(4-methylphenyl)hexan-1-amine

C14H23N — CID 43481744

IUPACN-methyl-1-(4-methylphenyl)hexan-1-amine
SMILESCCCCCC(NC)c1ccc(C)cc1
InChIInChI=1S/C14H23N/c1-4-5-6-7-14(15-3)13-10-8-12(2)9-11-13/h8-11,14-15H,4-7H2,1-3H3
InChIKeyPNPNKULGTSQSFW-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.84
Rot. Bonds6

About N-methyl-1-(4-methylphenyl)hexan-1-amine

N-methyl-1-(4-methylphenyl)hexan-1-amine (PubChem CID 43481744) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-methyl-1-(4-methylphenyl)hexan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(4-methylphenyl)hexan-1-amine
PubChem CID43481744
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-methyl-1-(4-methylphenyl)hexan-1-amine
SMILESCCCCCC(NC)c1ccc(C)cc1
InChIInChI=1S/C14H23N/c1-4-5-6-7-14(15-3)13-10-8-12(2)9-11-13/h8-11,14-15H,4-7H2,1-3H3
InChIKeyPNPNKULGTSQSFW-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.84
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-(4-iodophenyl)-N-methyldecan-1-amine
CID 115831490
1-(4-methylphenyl)heptylhydrazine
CID 105194415
N',N'-dibutyl-N-methyl-1-(4-methylphenyl)propane-1,3-diamine
CID 63482896
1-(3,5-dimethylphenyl)-N-methylhexan-1-amine
CID 115797265
1-(4-ethylsulfanylphenyl)-N-methylnonan-1-amine
CID 106848917
N-methyl-1-pyridin-4-yldecan-1-amine
CID 62600532
4-methoxy-N-methyl-1-(4-methylphenyl)butan-1-amine
CID 62602221
N-methyl-1-(4-propan-2-yloxyphenyl)hexan-1-amine
CID 43485534
1-(4-ethoxyphenyl)-N-methylheptan-1-amine
CID 114752328
N-methyl-1-(3-methylphenyl)decan-1-amine
CID 55186614
1-(4-chlorophenyl)-N-methylpentan-1-amine
CID 11708302
1-(4-iodophenyl)-N-methylpentan-1-amine
CID 115832799

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylphenyl)hexan-1-amine?
The IUPAC name of N-methyl-1-(4-methylphenyl)hexan-1-amine (CID 43481744) is N-methyl-1-(4-methylphenyl)hexan-1-amine.
What is the SMILES notation for N-methyl-1-(4-methylphenyl)hexan-1-amine?
The canonical SMILES for N-methyl-1-(4-methylphenyl)hexan-1-amine is CCCCCC(NC)c1ccc(C)cc1.
What is the InChIKey of N-methyl-1-(4-methylphenyl)hexan-1-amine?
The InChIKey is PNPNKULGTSQSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-4-5-6-7-14(15-3)13-10-8-12(2)9-11-13/h8-11,14-15H,4-7H2,1-3H3.
What are the key properties of N-methyl-1-(4-methylphenyl)hexan-1-amine?
N-methyl-1-(4-methylphenyl)hexan-1-amine has a molecular weight of 205.34 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylphenyl)hexan-1-amine is sourced from PubChem (CID 43481744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).