[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine

C14H28N2O — CID 43544407

IUPAC[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine
SMILESCC1CN(C2(CN)CCCCCC2)C(C)CO1
InChIInChI=1S/C14H28N2O/c1-12-10-17-13(2)9-16(12)14(11-15)7-5-3-4-6-8-14/h12-13H,3-11,15H2,1-2H3
InChIKeyWCTJIZGYDDJKOW-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.15
Rot. Bonds2

About [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine

[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine (PubChem CID 43544407) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine.

Molecular Properties

Compound Name[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine
PubChem CID43544407
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine
SMILESCC1CN(C2(CN)CCCCCC2)C(C)CO1
InChIInChI=1S/C14H28N2O/c1-12-10-17-13(2)9-16(12)14(11-15)7-5-3-4-6-8-14/h12-13H,3-11,15H2,1-2H3
InChIKeyWCTJIZGYDDJKOW-UHFFFAOYSA-N
XLogP2.15
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 ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2,2-Dimethylmorpholin-4-yl)cyclohexyl]methanamine
CID 43592696
[3-Methyl-1-(2-methylmorpholin-4-yl)cyclohexyl]methanamine
CID 24708366
1-[1-(Morpholin-4-yl)cyclopentyl]ethan-1-amine
CID 54595572
8,8,8-Trifluoro-3-methyl-3-morpholin-4-yloctan-4-amine
CID 115517212
(1-Morpholinocycloheptyl)methanamine
CID 16774192
rel-1-[(2R,6S)-2,6-Dimethyl-4-morpholinyl]cyclohexanemethanamine
CID 28211550
N-methyl-1-(1-morpholin-4-ylcycloheptyl)methanamine
CID 57697835
3-[1-(2-Methoxyethyl)piperidin-2-yl]pentan-3-amine
CID 57922410
6-methyl-N-(2-morpholin-4-ylethyl)undecan-6-amine
CID 130471504
[(2R)-4-(4-methyldecan-4-yl)morpholin-2-yl]methanamine
CID 132093673
4-methyl-N-(2-morpholin-4-ylethyl)octan-4-amine
CID 135158294
2,2,6,6-Tetramethyl-1-(oxiran-2-ylmethyl)piperidin-3-amine
CID 141318729

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
The IUPAC name of [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine (CID 43544407) is [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine.
What is the SMILES notation for [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
The canonical SMILES for [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine is CC1CN(C2(CN)CCCCCC2)C(C)CO1.
What is the InChIKey of [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
The InChIKey is WCTJIZGYDDJKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12-10-17-13(2)9-16(12)14(11-15)7-5-3-4-6-8-14/h12-13H,3-11,15H2,1-2H3.
What are the key properties of [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine?
[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine has a molecular weight of 240.39 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine is sourced from PubChem (CID 43544407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).