N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine

C15H30N2O — CID 104575278

IUPACN-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine
SMILESCC(C)(C)C1CCC(CNN2CCOCC2)CC1
InChIInChI=1S/C15H30N2O/c1-15(2,3)14-6-4-13(5-7-14)12-16-17-8-10-18-11-9-17/h13-14,16H,4-12H2,1-3H3
InChIKeyKHCBPDAGFFAXLE-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.68
Rot. Bonds3

About N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine

N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine (PubChem CID 104575278) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine.

Molecular Properties

Compound NameN-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine
PubChem CID104575278
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine
SMILESCC(C)(C)C1CCC(CNN2CCOCC2)CC1
InChIInChI=1S/C15H30N2O/c1-15(2,3)14-6-4-13(5-7-14)12-16-17-8-10-18-11-9-17/h13-14,16H,4-12H2,1-3H3
InChIKeyKHCBPDAGFFAXLE-UHFFFAOYSA-N
XLogP2.68
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine?
The IUPAC name of N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine (CID 104575278) is N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine.
What is the SMILES notation for N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine?
The canonical SMILES for N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine is CC(C)(C)C1CCC(CNN2CCOCC2)CC1.
What is the InChIKey of N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine?
The InChIKey is KHCBPDAGFFAXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-15(2,3)14-6-4-13(5-7-14)12-16-17-8-10-18-11-9-17/h13-14,16H,4-12H2,1-3H3.
What are the key properties of N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine?
N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine has a molecular weight of 254.42 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-tert-butylcyclohexyl)methyl]morpholin-4-amine is sourced from PubChem (CID 104575278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).