5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride

C20H26ClN3O2 — CID 45484302

IUPAC5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride
SMILESCl.O=C(CCCCN1CCOCC1)Nc1ccc(-c2cccnc2)cc1
InChIInChI=1S/C20H25N3O2.ClH/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18;/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24);1H
InChIKeyGBMDUJQQSGOIFW-UHFFFAOYSA-N
MW375.90 g/mol
LogP3.61
Rot. Bonds7

About 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride

5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride (PubChem CID 45484302) has the molecular formula C20H26ClN3O2 and a molecular weight of 375.90 g/mol. Its IUPAC name is 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride
PubChem CID45484302
Molecular FormulaC20H26ClN3O2
Molecular Weight375.90 g/mol
Exact Mass375.17
IUPAC Name5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride
SMILESCl.O=C(CCCCN1CCOCC1)Nc1ccc(-c2cccnc2)cc1
InChIInChI=1S/C20H25N3O2.ClH/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18;/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24);1H
InChIKeyGBMDUJQQSGOIFW-UHFFFAOYSA-N
XLogP3.61
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.90
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Kx2-361
CID 11545920
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CID 57519544
N-[4-(pyridin-4-ylmethyl)phenyl]acetamide
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6-(Pyridin-3-yl)-3,4-dihydroquinolin-2(1H)-one
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N'-[(E)-[4-(Morpholin-4-YL)phenyl]methylidene]pyridine-4-carbohydrazide
CID 6906007
N-[4-(4-Morpholinyl)phenyl]-4-pyridinemethanamine
CID 788565
(1S,2S)-N-{4-[(1S)-1-(propanoylamino)ethyl]phenyl}-2-(pyridin-3-yl)cyclopropane-1-carboxamide
CID 134817505
N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 7949225
1-(2-methoxyethyl)-N-[(3-methyl-2-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 24819416
Way-317538
CID 45484303
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CID 45484395

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride?
The IUPAC name of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride (CID 45484302) is 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride.
What is the SMILES notation for 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride?
The canonical SMILES for 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride is Cl.O=C(CCCCN1CCOCC1)Nc1ccc(-c2cccnc2)cc1.
What is the InChIKey of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride?
The InChIKey is GBMDUJQQSGOIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2.ClH/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18;/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24);1H.
What are the key properties of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride?
5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride has a molecular weight of 375.90 g/mol, XLogP of 3.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride is sourced from PubChem (CID 45484302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).