N-methyl-5-phenyl-N-propylpentan-1-amine

C15H25N — CID 18790258

IUPACN-methyl-5-phenyl-N-propylpentan-1-amine
SMILESCCCN(C)CCCCCc1ccccc1
InChIInChI=1S/C15H25N/c1-3-13-16(2)14-9-5-8-12-15-10-6-4-7-11-15/h4,6-7,10-11H,3,5,8-9,12-14H2,1-2H3
InChIKeyUKCLXTUJNBOJII-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.74
Rot. Bonds8

About N-methyl-5-phenyl-N-propylpentan-1-amine

N-methyl-5-phenyl-N-propylpentan-1-amine (PubChem CID 18790258) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N-methyl-5-phenyl-N-propylpentan-1-amine.

Molecular Properties

Compound NameN-methyl-5-phenyl-N-propylpentan-1-amine
PubChem CID18790258
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN-methyl-5-phenyl-N-propylpentan-1-amine
SMILESCCCN(C)CCCCCc1ccccc1
InChIInChI=1S/C15H25N/c1-3-13-16(2)14-9-5-8-12-15-10-6-4-7-11-15/h4,6-7,10-11H,3,5,8-9,12-14H2,1-2H3
InChIKeyUKCLXTUJNBOJII-UHFFFAOYSA-N
XLogP3.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-phenyl-N-propylpentan-1-amine?
The IUPAC name of N-methyl-5-phenyl-N-propylpentan-1-amine (CID 18790258) is N-methyl-5-phenyl-N-propylpentan-1-amine.
What is the SMILES notation for N-methyl-5-phenyl-N-propylpentan-1-amine?
The canonical SMILES for N-methyl-5-phenyl-N-propylpentan-1-amine is CCCN(C)CCCCCc1ccccc1.
What is the InChIKey of N-methyl-5-phenyl-N-propylpentan-1-amine?
The InChIKey is UKCLXTUJNBOJII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-3-13-16(2)14-9-5-8-12-15-10-6-4-7-11-15/h4,6-7,10-11H,3,5,8-9,12-14H2,1-2H3.
What are the key properties of N-methyl-5-phenyl-N-propylpentan-1-amine?
N-methyl-5-phenyl-N-propylpentan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.74, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-phenyl-N-propylpentan-1-amine is sourced from PubChem (CID 18790258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).