N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine

C14H25F3N2O — CID 64757570

IUPACN-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine
SMILESCC(CN1CCOCC1)NC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C14H25F3N2O/c1-11(10-19-5-7-20-8-6-19)18-13-4-2-3-12(9-13)14(15,16)17/h11-13,18H,2-10H2,1H3
InChIKeyBYVVKCMCYDUWSU-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.42
Rot. Bonds4

About N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine

N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine (PubChem CID 64757570) has the molecular formula C14H25F3N2O and a molecular weight of 294.36 g/mol. Its IUPAC name is N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine
PubChem CID64757570
Molecular FormulaC14H25F3N2O
Molecular Weight294.36 g/mol
Exact Mass294.19
IUPAC NameN-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine
SMILESCC(CN1CCOCC1)NC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C14H25F3N2O/c1-11(10-19-5-7-20-8-6-19)18-13-4-2-3-12(9-13)14(15,16)17/h11-13,18H,2-10H2,1H3
InChIKeyBYVVKCMCYDUWSU-UHFFFAOYSA-N
XLogP2.42
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine?
The IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine (CID 64757570) is N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine.
What is the SMILES notation for N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine?
The canonical SMILES for N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine is CC(CN1CCOCC1)NC1CCCC(C(F)(F)F)C1.
What is the InChIKey of N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine?
The InChIKey is BYVVKCMCYDUWSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O/c1-11(10-19-5-7-20-8-6-19)18-13-4-2-3-12(9-13)14(15,16)17/h11-13,18H,2-10H2,1H3.
What are the key properties of N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine?
N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine has a molecular weight of 294.36 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)cyclohexan-1-amine is sourced from PubChem (CID 64757570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).