N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine

C22H34N2O3 — CID 120915787

IUPACN-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
SMILESCOc1ccc(C2(CNC3CCCC3C3COCCN3)CCOCC2)cc1
InChIInChI=1S/C22H34N2O3/c1-25-18-7-5-17(6-8-18)22(9-12-26-13-10-22)16-24-20-4-2-3-19(20)21-15-27-14-11-23-21/h5-8,19-21,23-24H,2-4,9-16H2,1H3
InChIKeyVZWZSTOEXYBUPV-UHFFFAOYSA-N
MW374.53 g/mol
LogP2.49
Rot. Bonds6

About N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine

N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine (PubChem CID 120915787) has the molecular formula C22H34N2O3 and a molecular weight of 374.53 g/mol. Its IUPAC name is N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
PubChem CID120915787
Molecular FormulaC22H34N2O3
Molecular Weight374.53 g/mol
Exact Mass374.26
IUPAC NameN-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
SMILESCOc1ccc(C2(CNC3CCCC3C3COCCN3)CCOCC2)cc1
InChIInChI=1S/C22H34N2O3/c1-25-18-7-5-17(6-8-18)22(9-12-26-13-10-22)16-24-20-4-2-3-19(20)21-15-27-14-11-23-21/h5-8,19-21,23-24H,2-4,9-16H2,1H3
InChIKeyVZWZSTOEXYBUPV-UHFFFAOYSA-N
XLogP2.49
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine with MolForge

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Related Compounds

N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914474
N-[[1-(3-methoxyphenyl)cyclopentyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915676
2-morpholin-3-yl-N-[(1-phenylcyclopentyl)methyl]cyclopentan-1-amine
CID 120915053
2-morpholin-3-yl-N-[(1-phenylcyclobutyl)methyl]cyclopentan-1-amine
CID 120915057
N-[[4-(4-methoxyphenyl)thiophen-2-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915106
N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120915889
N-[2-(2-methoxyphenoxy)propyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120914873
N-[[1-(2-methylpropyl)cyclopropyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120916095
N-[2-(4-fluorophenoxy)ethyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120913887
2-morpholin-3-yl-N-[[1-(morpholin-4-ylmethyl)cyclohexyl]methyl]cyclopentan-1-amine
CID 120915365
N-(cyclopentylmethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915794
N-[2-(2-methoxyphenyl)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914428

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
The IUPAC name of N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine (CID 120915787) is N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine.
What is the SMILES notation for N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
The canonical SMILES for N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine is COc1ccc(C2(CNC3CCCC3C3COCCN3)CCOCC2)cc1.
What is the InChIKey of N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
The InChIKey is VZWZSTOEXYBUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O3/c1-25-18-7-5-17(6-8-18)22(9-12-26-13-10-22)16-24-20-4-2-3-19(20)21-15-27-14-11-23-21/h5-8,19-21,23-24H,2-4,9-16H2,1H3.
What are the key properties of N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine?
N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine has a molecular weight of 374.53 g/mol, XLogP of 2.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine is sourced from PubChem (CID 120915787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).