2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol

C15H30N2O2 — CID 64798573

IUPAC2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol
SMILESCCC1COCCN1CC(CO)(NC(C)C)C1CC1
InChIInChI=1S/C15H30N2O2/c1-4-14-9-19-8-7-17(14)10-15(11-18,13-5-6-13)16-12(2)3/h12-14,16,18H,4-11H2,1-3H3
InChIKeyDINLQVLWCOPVRO-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.24
Rot. Bonds7

About 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol

2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol (PubChem CID 64798573) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol
PubChem CID64798573
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol
SMILESCCC1COCCN1CC(CO)(NC(C)C)C1CC1
InChIInChI=1S/C15H30N2O2/c1-4-14-9-19-8-7-17(14)10-15(11-18,13-5-6-13)16-12(2)3/h12-14,16,18H,4-11H2,1-3H3
InChIKeyDINLQVLWCOPVRO-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol (CID 64798573) is 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol is CCC1COCCN1CC(CO)(NC(C)C)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol?
The InChIKey is DINLQVLWCOPVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-4-14-9-19-8-7-17(14)10-15(11-18,13-5-6-13)16-12(2)3/h12-14,16,18H,4-11H2,1-3H3.
What are the key properties of 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol?
2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol has a molecular weight of 270.42 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(3-ethylmorpholin-4-yl)-2-(propan-2-ylamino)propan-1-ol is sourced from PubChem (CID 64798573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).