3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine

C15H23NO — CID 114993811

IUPAC3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine
SMILESCOCCC(N)C1(c2ccccc2)CCCC1
InChIInChI=1S/C15H23NO/c1-17-12-9-14(16)15(10-5-6-11-15)13-7-3-2-4-8-13/h2-4,7-8,14H,5-6,9-12,16H2,1H3
InChIKeyXLJMSFTYMIHJQD-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.86
Rot. Bonds5

About 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine

3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine (PubChem CID 114993811) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine
PubChem CID114993811
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine
SMILESCOCCC(N)C1(c2ccccc2)CCCC1
InChIInChI=1S/C15H23NO/c1-17-12-9-14(16)15(10-5-6-11-15)13-7-3-2-4-8-13/h2-4,7-8,14H,5-6,9-12,16H2,1H3
InChIKeyXLJMSFTYMIHJQD-UHFFFAOYSA-N
XLogP2.86
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine?
The IUPAC name of 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine (CID 114993811) is 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine.
What is the SMILES notation for 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine?
The canonical SMILES for 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine is COCCC(N)C1(c2ccccc2)CCCC1.
What is the InChIKey of 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine?
The InChIKey is XLJMSFTYMIHJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-17-12-9-14(16)15(10-5-6-11-15)13-7-3-2-4-8-13/h2-4,7-8,14H,5-6,9-12,16H2,1H3.
What are the key properties of 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine?
3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine has a molecular weight of 233.35 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(1-phenylcyclopentyl)propan-1-amine is sourced from PubChem (CID 114993811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).