N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine

C23H30N2O3 — CID 120915889

IUPACN-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
SMILESCOc1ccccc1Oc1ccc(CNC2CCCC2C2COCCN2)cc1
InChIInChI=1S/C23H30N2O3/c1-26-22-7-2-3-8-23(22)28-18-11-9-17(10-12-18)15-25-20-6-4-5-19(20)21-16-27-14-13-24-21/h2-3,7-12,19-21,24-25H,4-6,13-16H2,1H3
InChIKeyKFYRSCSTPLLYLA-UHFFFAOYSA-N
MW382.50 g/mol
LogP3.73
Rot. Bonds7

About N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine

N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine (PubChem CID 120915889) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
PubChem CID120915889
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC NameN-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
SMILESCOc1ccccc1Oc1ccc(CNC2CCCC2C2COCCN2)cc1
InChIInChI=1S/C23H30N2O3/c1-26-22-7-2-3-8-23(22)28-18-11-9-17(10-12-18)15-25-20-6-4-5-19(20)21-16-27-14-13-24-21/h2-3,7-12,19-21,24-25H,4-6,13-16H2,1H3
InChIKeyKFYRSCSTPLLYLA-UHFFFAOYSA-N
XLogP3.73
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
The IUPAC name of N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine (CID 120915889) is N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine.
What is the SMILES notation for N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
The canonical SMILES for N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine is COc1ccccc1Oc1ccc(CNC2CCCC2C2COCCN2)cc1.
What is the InChIKey of N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
The InChIKey is KFYRSCSTPLLYLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c1-26-22-7-2-3-8-23(22)28-18-11-9-17(10-12-18)15-25-20-6-4-5-19(20)21-16-27-14-13-24-21/h2-3,7-12,19-21,24-25H,4-6,13-16H2,1H3.
What are the key properties of N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine has a molecular weight of 382.50 g/mol, XLogP of 3.73, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine is sourced from PubChem (CID 120915889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).