N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide

C14H19ClN2O3 — CID 567615

IUPACN-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCN1CCOCC1
InChIInChI=1S/C14H19ClN2O3/c1-19-13-3-2-11(15)10-12(13)16-14(18)4-5-17-6-8-20-9-7-17/h2-3,10H,4-9H2,1H3,(H,16,18)
InChIKeyJAOFJPPMQPUHEF-UHFFFAOYSA-N
MW298.77 g/mol
LogP2.01
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide

N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide (PubChem CID 567615) has the molecular formula C14H19ClN2O3 and a molecular weight of 298.77 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide
PubChem CID567615
Molecular FormulaC14H19ClN2O3
Molecular Weight298.77 g/mol
Exact Mass298.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCN1CCOCC1
InChIInChI=1S/C14H19ClN2O3/c1-19-13-3-2-11(15)10-12(13)16-14(18)4-5-17-6-8-20-9-7-17/h2-3,10H,4-9H2,1H3,(H,16,18)
InChIKeyJAOFJPPMQPUHEF-UHFFFAOYSA-N
XLogP2.01
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide (CID 567615) is N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide is COc1ccc(Cl)cc1NC(=O)CCN1CCOCC1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide?
The InChIKey is JAOFJPPMQPUHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3/c1-19-13-3-2-11(15)10-12(13)16-14(18)4-5-17-6-8-20-9-7-17/h2-3,10H,4-9H2,1H3,(H,16,18).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide?
N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide has a molecular weight of 298.77 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 567615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).