2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine

C14H28N2O — CID 62615947

IUPAC2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine
SMILESCC1CN(CC2CCCCCC2N)C(C)CO1
InChIInChI=1S/C14H28N2O/c1-11-10-17-12(2)8-16(11)9-13-6-4-3-5-7-14(13)15/h11-14H,3-10,15H2,1-2H3
InChIKeyKWQIYMATEFXOPR-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.00
Rot. Bonds2

About 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine

2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine (PubChem CID 62615947) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine.

Molecular Properties

Compound Name2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine
PubChem CID62615947
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine
SMILESCC1CN(CC2CCCCCC2N)C(C)CO1
InChIInChI=1S/C14H28N2O/c1-11-10-17-12(2)8-16(11)9-13-6-4-3-5-7-14(13)15/h11-14H,3-10,15H2,1-2H3
InChIKeyKWQIYMATEFXOPR-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]cycloheptan-1-amine
CID 62609313
2-[2-(2,5-dimethylmorpholin-4-yl)ethyl]cyclopentan-1-amine
CID 79569935
4-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-amine
CID 66236109
2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-ethylcyclohexan-1-amine
CID 62615942
2,5-dimethyl-4-[(4-methylpyrrolidin-3-yl)methyl]morpholine
CID 63713863
2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-methylcyclohexan-1-ol
CID 62610594
1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine
CID 43544729
2-[(2,5-dimethylmorpholin-4-yl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 62616102
2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol
CID 62707954
1-cyclopentyl-2-(2,5-dimethylmorpholin-4-yl)ethanol
CID 104752531
1-[2-(2,5-dimethylmorpholin-4-yl)ethyl]piperidin-4-amine
CID 79327606
3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxan-4-amine
CID 103059609

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine?
The IUPAC name of 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine (CID 62615947) is 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine.
What is the SMILES notation for 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine?
The canonical SMILES for 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine is CC1CN(CC2CCCCCC2N)C(C)CO1.
What is the InChIKey of 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine?
The InChIKey is KWQIYMATEFXOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11-10-17-12(2)8-16(11)9-13-6-4-3-5-7-14(13)15/h11-14H,3-10,15H2,1-2H3.
What are the key properties of 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine?
2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine has a molecular weight of 240.39 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine is sourced from PubChem (CID 62615947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).