2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide

C19H20ClN3O2 — CID 56865554

IUPAC2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide
SMILESO=C(NC1CC1)c1ccnc(N2CCOC(c3ccc(Cl)cc3)C2)c1
InChIInChI=1S/C19H20ClN3O2/c20-15-3-1-13(2-4-15)17-12-23(9-10-25-17)18-11-14(7-8-21-18)19(24)22-16-5-6-16/h1-4,7-8,11,16-17H,5-6,9-10,12H2,(H,22,24)
InChIKeyTVMFPCHKVZXGDE-UHFFFAOYSA-N
MW357.84 g/mol
LogP3.21
Rot. Bonds4

About 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide

2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide (PubChem CID 56865554) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide
PubChem CID56865554
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide
SMILESO=C(NC1CC1)c1ccnc(N2CCOC(c3ccc(Cl)cc3)C2)c1
InChIInChI=1S/C19H20ClN3O2/c20-15-3-1-13(2-4-15)17-12-23(9-10-25-17)18-11-14(7-8-21-18)19(24)22-16-5-6-16/h1-4,7-8,11,16-17H,5-6,9-10,12H2,(H,22,24)
InChIKeyTVMFPCHKVZXGDE-UHFFFAOYSA-N
XLogP3.21
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide?
The IUPAC name of 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide (CID 56865554) is 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide is O=C(NC1CC1)c1ccnc(N2CCOC(c3ccc(Cl)cc3)C2)c1.
What is the InChIKey of 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide?
The InChIKey is TVMFPCHKVZXGDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c20-15-3-1-13(2-4-15)17-12-23(9-10-25-17)18-11-14(7-8-21-18)19(24)22-16-5-6-16/h1-4,7-8,11,16-17H,5-6,9-10,12H2,(H,22,24).
What are the key properties of 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide?
2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide has a molecular weight of 357.84 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)morpholin-4-yl]-N-cyclopropylpyridine-4-carboxamide is sourced from PubChem (CID 56865554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).