1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine

C17H26N2O2 — CID 117469481

IUPAC1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine
SMILESCOc1ccc(N2CCOCC2)cc1C1(N)CCCCC1
InChIInChI=1S/C17H26N2O2/c1-20-16-6-5-14(19-9-11-21-12-10-19)13-15(16)17(18)7-3-2-4-8-17/h5-6,13H,2-4,7-12,18H2,1H3
InChIKeyVVKHQJLWFZRPDB-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.65
Rot. Bonds3

About 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine

1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine (PubChem CID 117469481) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine
PubChem CID117469481
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine
SMILESCOc1ccc(N2CCOCC2)cc1C1(N)CCCCC1
InChIInChI=1S/C17H26N2O2/c1-20-16-6-5-14(19-9-11-21-12-10-19)13-15(16)17(18)7-3-2-4-8-17/h5-6,13H,2-4,7-12,18H2,1H3
InChIKeyVVKHQJLWFZRPDB-UHFFFAOYSA-N
XLogP2.65
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

4-(5-fluoro-2-methoxyphenyl)oxepan-4-amine
CID 82770544
4-(5-fluoro-2-methoxyphenyl)oxan-4-amine
CID 80503676
4-[3,5-dimethoxy-4-[(2-methoxy-4-morpholin-4-ylphenyl)methyl]phenyl]morpholine
CID 135200868
1-(5-cyclopentyl-2-methoxyphenyl)cyclohexan-1-amine
CID 117436622
4-(2-methoxy-5-propan-2-ylphenyl)oxan-4-amine
CID 82297013
2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol
CID 117384184
4-(4-methoxy-2-methylquinolin-6-yl)-1,4-oxazepane
CID 166834682
1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
CID 43146587
4-(2-methoxy-5-morpholin-4-ylphenyl)-1-methylpyrazol-5-amine
CID 117465938
(E)-3-(2-methoxy-5-morpholin-4-ylphenyl)prop-2-en-1-amine
CID 117374281
1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine
CID 117347443
4-[4-(1,1-dimethoxyethyl)-3-methoxyphenyl]morpholine
CID 174708451

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine?
The IUPAC name of 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine (CID 117469481) is 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine?
The canonical SMILES for 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine is COc1ccc(N2CCOCC2)cc1C1(N)CCCCC1.
What is the InChIKey of 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine?
The InChIKey is VVKHQJLWFZRPDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-20-16-6-5-14(19-9-11-21-12-10-19)13-15(16)17(18)7-3-2-4-8-17/h5-6,13H,2-4,7-12,18H2,1H3.
What are the key properties of 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine?
1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine has a molecular weight of 290.41 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 117469481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).