N-tert-butylmorpholin-4-amine

C8H18N2O — CID 20626719

IUPACN-tert-butylmorpholin-4-amine
SMILESCC(C)(C)NN1CCOCC1
InChIInChI=1S/C8H18N2O/c1-8(2,3)9-10-4-6-11-7-5-10/h9H,4-7H2,1-3H3
InChIKeyVMQCGOIDPWGJQA-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.62
Rot. Bonds1

About N-tert-butylmorpholin-4-amine

N-tert-butylmorpholin-4-amine (PubChem CID 20626719) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is N-tert-butylmorpholin-4-amine.

Molecular Properties

Compound NameN-tert-butylmorpholin-4-amine
PubChem CID20626719
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC NameN-tert-butylmorpholin-4-amine
SMILESCC(C)(C)NN1CCOCC1
InChIInChI=1S/C8H18N2O/c1-8(2,3)9-10-4-6-11-7-5-10/h9H,4-7H2,1-3H3
InChIKeyVMQCGOIDPWGJQA-UHFFFAOYSA-N
XLogP0.62
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-N-morpholin-4-ylpropane-1,2-diamine
CID 83013693
N-(2,2-dimethylpropyl)morpholin-4-amine
CID 83009636
N-morpholin-4-ylthiohydroxylamine;trihydrofluoride
CID 173110746
N-methyl-2-morpholin-4-ylpropan-2-amine
CID 166844618
2,2-dimethyl-4-(morpholin-4-ylamino)butanenitrile
CID 83020850
4-(2,2,4,4-tetramethylpentan-3-yl)morpholine
CID 57301157
2-morpholin-4-ylpropane-2-thiol
CID 139318537
CID 58998301
CID 58998301
N-(morpholin-4-ylmethyl)propan-2-amine
CID 59379058
5,5-dimethyl-N-morpholin-4-yl-2,4-dioxohexanamide
CID 139707460
2-amino-2-methyl-N-morpholin-4-ylbutanamide
CID 83016006
N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine
CID 104575278

Frequently Asked Questions

What is the IUPAC name of N-tert-butylmorpholin-4-amine?
The IUPAC name of N-tert-butylmorpholin-4-amine (CID 20626719) is N-tert-butylmorpholin-4-amine.
What is the SMILES notation for N-tert-butylmorpholin-4-amine?
The canonical SMILES for N-tert-butylmorpholin-4-amine is CC(C)(C)NN1CCOCC1.
What is the InChIKey of N-tert-butylmorpholin-4-amine?
The InChIKey is VMQCGOIDPWGJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-8(2,3)9-10-4-6-11-7-5-10/h9H,4-7H2,1-3H3.
What are the key properties of N-tert-butylmorpholin-4-amine?
N-tert-butylmorpholin-4-amine has a molecular weight of 158.24 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butylmorpholin-4-amine is sourced from PubChem (CID 20626719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).