N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine

C15H23NO — CID 60797775

IUPACN-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
SMILESCCNC(c1cccc(OC)c1)C1CCCC1
InChIInChI=1S/C15H23NO/c1-3-16-15(12-7-4-5-8-12)13-9-6-10-14(11-13)17-2/h6,9-12,15-16H,3-5,7-8H2,1-2H3
InChIKeyKYQOYSOXMGHTEQ-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.54
Rot. Bonds5

About N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine

N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine (PubChem CID 60797775) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
PubChem CID60797775
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
SMILESCCNC(c1cccc(OC)c1)C1CCCC1
InChIInChI=1S/C15H23NO/c1-3-16-15(12-7-4-5-8-12)13-9-6-10-14(11-13)17-2/h6,9-12,15-16H,3-5,7-8H2,1-2H3
InChIKeyKYQOYSOXMGHTEQ-UHFFFAOYSA-N
XLogP3.54
TPSA21.26 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 ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[cyclopropyl-(3-methoxyphenyl)methyl]ethanamine
CID 60820098
N-[(3-methoxyphenyl)-(3-methylcyclopentyl)methyl]ethanamine
CID 65415595
[cyclohexyl-(3-methoxyphenyl)methyl]hydrazine
CID 105191678
N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine
CID 60818890
N-[cycloheptyl-(3-methylphenyl)methyl]ethanamine
CID 65399254
N-[cycloheptyl-(3-iodophenyl)methyl]ethanamine
CID 105027846
1-cyclopentyl-N-ethyl-2-(3-methoxyphenoxy)ethanamine
CID 104748428
N-[cycloheptyl-(3-methoxy-4-methylphenyl)methyl]ethanamine
CID 105027735
N-[cycloheptyl-(3,4-dimethoxyphenyl)methyl]ethanamine
CID 62587576
N-[cycloheptyl-(3-propylphenyl)methyl]ethanamine
CID 116544538
N-[cyclooctyl-(3-propylphenyl)methyl]ethanamine
CID 116544896
2-cyclohexyl-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 82936496

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine?
The IUPAC name of N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine (CID 60797775) is N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine?
The canonical SMILES for N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine is CCNC(c1cccc(OC)c1)C1CCCC1.
What is the InChIKey of N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine?
The InChIKey is KYQOYSOXMGHTEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-16-15(12-7-4-5-8-12)13-9-6-10-14(11-13)17-2/h6,9-12,15-16H,3-5,7-8H2,1-2H3.
What are the key properties of N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine?
N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine has a molecular weight of 233.35 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine is sourced from PubChem (CID 60797775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).