[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone

C17H32N2O2 — CID 81485314

IUPAC[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone
SMILESCC(N)C1CN(C(=O)C2CCC(C(C)(C)C)CC2)CCO1
InChIInChI=1S/C17H32N2O2/c1-12(18)15-11-19(9-10-21-15)16(20)13-5-7-14(8-6-13)17(2,3)4/h12-15H,5-11,18H2,1-4H3
InChIKeyRLZSXOJJPFTKJJ-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.41
Rot. Bonds2

About [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone

[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone (PubChem CID 81485314) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone.

Molecular Properties

Compound Name[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone
PubChem CID81485314
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone
SMILESCC(N)C1CN(C(=O)C2CCC(C(C)(C)C)CC2)CCO1
InChIInChI=1S/C17H32N2O2/c1-12(18)15-11-19(9-10-21-15)16(20)13-5-7-14(8-6-13)17(2,3)4/h12-15H,5-11,18H2,1-4H3
InChIKeyRLZSXOJJPFTKJJ-UHFFFAOYSA-N
XLogP2.41
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(1-aminoethyl)morpholin-4-yl]-(1-methylpyrrolidin-3-yl)methanone
CID 115315156
[2-(1-aminoethyl)morpholin-4-yl]-(6-bicyclo[3.1.0]hexanyl)methanone
CID 81484253
[2-(1-aminoethyl)morpholin-4-yl]-(2-methyloxolan-3-yl)methanone
CID 115315098
[2-(1-aminoethyl)morpholin-4-yl]-(oxan-2-yl)methanone
CID 113285006
5-[2-(1-aminoethyl)morpholine-4-carbonyl]piperidin-2-one
CID 81484363
(4-tert-butylcyclohexyl)-morpholin-4-ylmethanone;ethane
CID 164918983
2-amino-1-[2-(1-aminoethyl)morpholin-4-yl]propan-1-one
CID 131134178
(3-aminopyrrolidin-1-yl)-(4-tert-butylcyclohexyl)methanone
CID 62717919
1-[2-(1-aminoethyl)morpholin-4-yl]-3-methylbut-2-en-1-one
CID 81484614
tert-butyl 3-(2-propan-2-ylmorpholine-4-carbonyl)pyrrolidine-1-carboxylate
CID 75448497
[3-(1-aminoethyl)pyrrolidin-1-yl]-cyclopropylmethanone
CID 112630526
(4-tert-butylcyclohexyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 62718074

Frequently Asked Questions

What is the IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone?
The IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone (CID 81485314) is [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone.
What is the SMILES notation for [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone?
The canonical SMILES for [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone is CC(N)C1CN(C(=O)C2CCC(C(C)(C)C)CC2)CCO1.
What is the InChIKey of [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone?
The InChIKey is RLZSXOJJPFTKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-12(18)15-11-19(9-10-21-15)16(20)13-5-7-14(8-6-13)17(2,3)4/h12-15H,5-11,18H2,1-4H3.
What are the key properties of [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone?
[2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone has a molecular weight of 296.45 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-aminoethyl)morpholin-4-yl]-(4-tert-butylcyclohexyl)methanone is sourced from PubChem (CID 81485314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).