N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine

C14H21NO — CID 62109252

IUPACN-methyl-2-(1-phenylethoxy)cyclopentan-1-amine
SMILESCNC1CCCC1OC(C)c1ccccc1
InChIInChI=1S/C14H21NO/c1-11(12-7-4-3-5-8-12)16-14-10-6-9-13(14)15-2/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3
InChIKeyBLDYCARWVAUEJN-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.90
Rot. Bonds4

About N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine

N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine (PubChem CID 62109252) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(1-phenylethoxy)cyclopentan-1-amine
PubChem CID62109252
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-methyl-2-(1-phenylethoxy)cyclopentan-1-amine
SMILESCNC1CCCC1OC(C)c1ccccc1
InChIInChI=1S/C14H21NO/c1-11(12-7-4-3-5-8-12)16-14-10-6-9-13(14)15-2/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3
InChIKeyBLDYCARWVAUEJN-UHFFFAOYSA-N
XLogP2.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine?
The IUPAC name of N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine (CID 62109252) is N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine.
What is the SMILES notation for N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine?
The canonical SMILES for N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine is CNC1CCCC1OC(C)c1ccccc1.
What is the InChIKey of N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine?
The InChIKey is BLDYCARWVAUEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(12-7-4-3-5-8-12)16-14-10-6-9-13(14)15-2/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3.
What are the key properties of N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine?
N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-phenylethoxy)cyclopentan-1-amine is sourced from PubChem (CID 62109252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).