N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine

C15H24N2 — CID 115208236

IUPACN-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
SMILESCCCc1ccc(CNCC2CCCN2)cc1
InChIInChI=1S/C15H24N2/c1-2-4-13-6-8-14(9-7-13)11-16-12-15-5-3-10-17-15/h6-9,15-17H,2-5,10-12H2,1H3
InChIKeyFUMHEHBIZUDRHG-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.48
Rot. Bonds6

About N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine

N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine (PubChem CID 115208236) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine.

Molecular Properties

Compound NameN-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
PubChem CID115208236
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
SMILESCCCc1ccc(CNCC2CCCN2)cc1
InChIInChI=1S/C15H24N2/c1-2-4-13-6-8-14(9-7-13)11-16-12-15-5-3-10-17-15/h6-9,15-17H,2-5,10-12H2,1H3
InChIKeyFUMHEHBIZUDRHG-UHFFFAOYSA-N
XLogP2.48
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(1,1-Dimethylethyl)benzenemethanamine
CID 76908
Norbenzphetamine
CID 102554
1-(4-Methylphenyl)ethylamine
CID 577386
N-Propylbenzylamine
CID 74850
N-Benzylamphetamine
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Bis(alpha-methylbenzyl)amine
CID 24804
Propylamphetamine
CID 103544

Frequently Asked Questions

What is the IUPAC name of N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine?
The IUPAC name of N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine (CID 115208236) is N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine.
What is the SMILES notation for N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine?
The canonical SMILES for N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine is CCCc1ccc(CNCC2CCCN2)cc1.
What is the InChIKey of N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine?
The InChIKey is FUMHEHBIZUDRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-2-4-13-6-8-14(9-7-13)11-16-12-15-5-3-10-17-15/h6-9,15-17H,2-5,10-12H2,1H3.
What are the key properties of N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine?
N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine has a molecular weight of 232.37 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-propylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine is sourced from PubChem (CID 115208236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).