1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol

C15H24N2O2S — CID 110885669

IUPAC1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESOC(CN1CCOCC1)CN(Cc1cccs1)C1CC1
InChIInChI=1S/C15H24N2O2S/c18-14(10-16-5-7-19-8-6-16)11-17(13-3-4-13)12-15-2-1-9-20-15/h1-2,9,13-14,18H,3-8,10-12H2
InChIKeyMKCJCAHGEIZPDT-UHFFFAOYSA-N
MW296.44 g/mol
LogP1.41
Rot. Bonds7

About 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol

1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 110885669) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol
PubChem CID110885669
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESOC(CN1CCOCC1)CN(Cc1cccs1)C1CC1
InChIInChI=1S/C15H24N2O2S/c18-14(10-16-5-7-19-8-6-16)11-17(13-3-4-13)12-15-2-1-9-20-15/h1-2,9,13-14,18H,3-8,10-12H2
InChIKeyMKCJCAHGEIZPDT-UHFFFAOYSA-N
XLogP1.41
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[cyclopropyl-[(3-fluorophenyl)methyl]amino]-3-morpholin-4-ylpropan-2-ol
CID 110898141
(2R)-1-[cyclopropyl(thiophen-2-ylmethyl)amino]propan-2-ol
CID 106932763
[(2R)-3-[cyclopropyl(thiophen-2-ylmethyl)amino]-2-hydroxypropyl] butanoate
CID 93147255
(2R)-1-morpholin-4-yl-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 2359827
2-[cyclopropyl(thiophen-2-ylmethyl)amino]-1-(4-fluorophenyl)ethanol
CID 110885670
1-[methyl(thiophen-2-ylmethyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65448493
1-[cyclopentyl(methyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 110882289
1-[cyclopropyl-(4-ethylcyclohexyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 110898637
2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-3,3,3-trifluoropropanethioamide
CID 103368611
1-[methyl-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]amino]-3-morpholin-4-ylpropan-2-ol
CID 111916465
1-[cyclopropyl(thiophen-2-ylmethyl)amino]propan-2-one
CID 62029716
(2S)-1-[2-methoxy-6-[[methyl(thiophen-2-ylmethyl)amino]methyl]phenoxy]-3-morpholin-4-ylpropan-2-ol
CID 29023159

Frequently Asked Questions

What is the IUPAC name of 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol (CID 110885669) is 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol is OC(CN1CCOCC1)CN(Cc1cccs1)C1CC1.
What is the InChIKey of 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is MKCJCAHGEIZPDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c18-14(10-16-5-7-19-8-6-16)11-17(13-3-4-13)12-15-2-1-9-20-15/h1-2,9,13-14,18H,3-8,10-12H2.
What are the key properties of 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol?
1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 296.44 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclopropyl(thiophen-2-ylmethyl)amino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 110885669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).