5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide

C19H24N2O2 — CID 94661779

IUPAC5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide
SMILESCOc1ccc(CCCCC(=O)N[C@H](C)c2cccnc2)cc1
InChIInChI=1S/C19H24N2O2/c1-15(17-7-5-13-20-14-17)21-19(22)8-4-3-6-16-9-11-18(23-2)12-10-16/h5,7,9-15H,3-4,6,8H2,1-2H3,(H,21,22)/t15-/m1/s1
InChIKeyMGYOXCKAKCMDHQ-OAHLLOKOSA-N
MW312.41 g/mol
LogP3.68
Rot. Bonds8

About 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide

5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide (PubChem CID 94661779) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide
PubChem CID94661779
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide
SMILESCOc1ccc(CCCCC(=O)N[C@H](C)c2cccnc2)cc1
InChIInChI=1S/C19H24N2O2/c1-15(17-7-5-13-20-14-17)21-19(22)8-4-3-6-16-9-11-18(23-2)12-10-16/h5,7,9-15H,3-4,6,8H2,1-2H3,(H,21,22)/t15-/m1/s1
InChIKeyMGYOXCKAKCMDHQ-OAHLLOKOSA-N
XLogP3.68
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(4-methoxyphenoxy)-N-(1-pyridin-3-ylethyl)butanamide
CID 51193160
3-(4-methoxyphenyl)-N-[(1S)-1-(3-pyridin-3-ylphenyl)ethyl]propanamide
CID 58739189
6-amino-N-(1-pyridin-3-ylethyl)hexanamide
CID 43523747
5-oxo-5-[[(1S)-1-pyridin-3-ylethyl]amino]pentanoic acid
CID 81407204
7-amino-N-(1-pyridin-3-ylethyl)heptanamide;hydrochloride
CID 119998836
3-(4-methoxyphenyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]propanamide
CID 42563582
6-oxo-6-phenyl-N-[(1R)-1-pyridin-3-ylethyl]hexanamide
CID 94172677
6-oxo-6-phenyl-N-(1-pyridin-3-ylethyl)hexanamide
CID 51085829
2-(4-methylphenyl)-N-(1-pyridin-3-ylethyl)acetamide
CID 18163057
N-(1-pyridin-3-ylethyl)-3-sulfanylpropanamide
CID 107022769
N-[(4-methoxyphenyl)methyl]-2-[[(1S)-1-pyridin-3-ylethyl]amino]acetamide
CID 97347952
3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylethyl)propanamide
CID 122560537

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide?
The IUPAC name of 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide (CID 94661779) is 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide?
The canonical SMILES for 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide is COc1ccc(CCCCC(=O)N[C@H](C)c2cccnc2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide?
The InChIKey is MGYOXCKAKCMDHQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15(17-7-5-13-20-14-17)21-19(22)8-4-3-6-16-9-11-18(23-2)12-10-16/h5,7,9-15H,3-4,6,8H2,1-2H3,(H,21,22)/t15-/m1/s1.
What are the key properties of 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide?
5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide has a molecular weight of 312.41 g/mol, XLogP of 3.68, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]pentanamide is sourced from PubChem (CID 94661779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).