N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide

C15H21N3O3 — CID 83102212

IUPACN-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
SMILESCC(O)c1ccnc(N2CCOCC2C(=O)NC2CC2)c1
InChIInChI=1S/C15H21N3O3/c1-10(19)11-4-5-16-14(8-11)18-6-7-21-9-13(18)15(20)17-12-2-3-12/h4-5,8,10,12-13,19H,2-3,6-7,9H2,1H3,(H,17,20)
InChIKeyBMJVNEVZVUVKGV-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.62
Rot. Bonds4

About N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide

N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide (PubChem CID 83102212) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
PubChem CID83102212
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
SMILESCC(O)c1ccnc(N2CCOCC2C(=O)NC2CC2)c1
InChIInChI=1S/C15H21N3O3/c1-10(19)11-4-5-16-14(8-11)18-6-7-21-9-13(18)15(20)17-12-2-3-12/h4-5,8,10,12-13,19H,2-3,6-7,9H2,1H3,(H,17,20)
InChIKeyBMJVNEVZVUVKGV-UHFFFAOYSA-N
XLogP0.62
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
The IUPAC name of N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide (CID 83102212) is N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide is CC(O)c1ccnc(N2CCOCC2C(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
The InChIKey is BMJVNEVZVUVKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-10(19)11-4-5-16-14(8-11)18-6-7-21-9-13(18)15(20)17-12-2-3-12/h4-5,8,10,12-13,19H,2-3,6-7,9H2,1H3,(H,17,20).
What are the key properties of N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide is sourced from PubChem (CID 83102212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).