(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine

C17H26N2O — CID 116517749

IUPAC(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C(N)C2CC2c2ccccc2)C1
InChIInChI=1S/C17H26N2O/c1-12(2)19-8-9-20-16(11-19)17(18)15-10-14(15)13-6-4-3-5-7-13/h3-7,12,14-17H,8-11,18H2,1-2H3
InChIKeyYTKYEEMMISAWDT-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.23
Rot. Bonds4

About (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine

(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine (PubChem CID 116517749) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
PubChem CID116517749
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C(N)C2CC2c2ccccc2)C1
InChIInChI=1S/C17H26N2O/c1-12(2)19-8-9-20-16(11-19)17(18)15-10-14(15)13-6-4-3-5-7-13/h3-7,12,14-17H,8-11,18H2,1-2H3
InChIKeyYTKYEEMMISAWDT-UHFFFAOYSA-N
XLogP2.23
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665183
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl-(2-phenylcyclopropyl)methanamine
CID 116517715
2-(2-chlorophenyl)-1-(4-propan-2-ylmorpholin-2-yl)ethanamine
CID 79665755
(4-propan-2-ylmorpholin-2-yl)-quinolin-3-ylmethanamine
CID 79665562
1-[(1R,2S)-2-phenylcyclopropyl]ethanamine
CID 57373127
(3-cyclobutylphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 114603947
(2-ethoxyphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79664711
(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 114688564
1-(2-phenylcyclopropyl)propan-1-amine
CID 116517334
(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665565
3-phenyl-1-propan-2-ylpyrrolidine
CID 3447557
(4-propan-2-ylmorpholin-2-yl)-quinolin-3-ylmethanol
CID 79665158

Frequently Asked Questions

What is the IUPAC name of (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The IUPAC name of (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine (CID 116517749) is (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The canonical SMILES for (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine is CC(C)N1CCOC(C(N)C2CC2c2ccccc2)C1.
What is the InChIKey of (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The InChIKey is YTKYEEMMISAWDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12(2)19-8-9-20-16(11-19)17(18)15-10-14(15)13-6-4-3-5-7-13/h3-7,12,14-17H,8-11,18H2,1-2H3.
What are the key properties of (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine has a molecular weight of 274.41 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 116517749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).