2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide

C18H27N3O3 — CID 69166296

IUPAC2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide
SMILESCCOc1cnc(NC(=O)C(C)C2CC2)cc1CN1CCOCC1
InChIInChI=1S/C18H27N3O3/c1-3-24-16-11-19-17(20-18(22)13(2)14-4-5-14)10-15(16)12-21-6-8-23-9-7-21/h10-11,13-14H,3-9,12H2,1-2H3,(H,19,20,22)
InChIKeyIATJGHAAATVASK-UHFFFAOYSA-N
MW333.43 g/mol
LogP2.30
Rot. Bonds7

About 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide

2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide (PubChem CID 69166296) has the molecular formula C18H27N3O3 and a molecular weight of 333.43 g/mol. Its IUPAC name is 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide
PubChem CID69166296
Molecular FormulaC18H27N3O3
Molecular Weight333.43 g/mol
Exact Mass333.21
IUPAC Name2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide
SMILESCCOc1cnc(NC(=O)C(C)C2CC2)cc1CN1CCOCC1
InChIInChI=1S/C18H27N3O3/c1-3-24-16-11-19-17(20-18(22)13(2)14-4-5-14)10-15(16)12-21-6-8-23-9-7-21/h10-11,13-14H,3-9,12H2,1-2H3,(H,19,20,22)
InChIKeyIATJGHAAATVASK-UHFFFAOYSA-N
XLogP2.30
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
The IUPAC name of 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide (CID 69166296) is 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
The canonical SMILES for 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide is CCOc1cnc(NC(=O)C(C)C2CC2)cc1CN1CCOCC1.
What is the InChIKey of 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
The InChIKey is IATJGHAAATVASK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O3/c1-3-24-16-11-19-17(20-18(22)13(2)14-4-5-14)10-15(16)12-21-6-8-23-9-7-21/h10-11,13-14H,3-9,12H2,1-2H3,(H,19,20,22).
What are the key properties of 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide has a molecular weight of 333.43 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[5-ethoxy-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 69166296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).