1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one

C14H24N2O2 — CID 114145307

IUPAC1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one
SMILESCCCC(CCO)CNCCn1ccccc1=O
InChIInChI=1S/C14H24N2O2/c1-2-5-13(7-11-17)12-15-8-10-16-9-4-3-6-14(16)18/h3-4,6,9,13,15,17H,2,5,7-8,10-12H2,1H3
InChIKeyLAXNQBQOQRLNAZ-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.24
Rot. Bonds9

About 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one

1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one (PubChem CID 114145307) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one
PubChem CID114145307
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one
SMILESCCCC(CCO)CNCCn1ccccc1=O
InChIInChI=1S/C14H24N2O2/c1-2-5-13(7-11-17)12-15-8-10-16-9-4-3-6-14(16)18/h3-4,6,9,13,15,17H,2,5,7-8,10-12H2,1H3
InChIKeyLAXNQBQOQRLNAZ-UHFFFAOYSA-N
XLogP1.24
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-3-[2-(2-hydroxyethyl)pentyl]-2-[[4-[(2-oxo-1-pyridinyl)methyl]phenyl]methyl]guanidine
CID 111712285
1-[3-(2-methylpropylamino)propyl]pyridin-2-one
CID 62564337
1-[2-[3-(dimethylamino)propylamino]ethyl]pyridin-2-one
CID 62564162
2-[2-(2-hydroxyethyl)pentylamino]-N-phenylacetamide
CID 106115428
1-[2-[(2-hydroxy-2-thiophen-3-ylethyl)amino]ethyl]pyridin-2-one
CID 114188509
N-methyl-3-[2-(2-oxo-1-pyridinyl)ethylamino]propanamide
CID 82897118
1-[2-[2-[di(propan-2-yl)amino]ethylamino]ethyl]pyridin-2-one
CID 82897282
ethyl 3-[2-(2-oxo-1-pyridinyl)ethylamino]propanoate
CID 82897754
1-[2-(benzylamino)ethyl]pyridin-2-one
CID 55070999
3-[(1-benzofuran-3-ylmethylamino)methyl]hexan-1-ol
CID 103826324
1-[2-(3-bromopropylamino)ethyl]pyridin-2-one
CID 82907735
2-[2-[2-(2-hydroxyethyl)pentylamino]ethoxy]benzoic acid
CID 106115841

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one?
The IUPAC name of 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one (CID 114145307) is 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one is CCCC(CCO)CNCCn1ccccc1=O.
What is the InChIKey of 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one?
The InChIKey is LAXNQBQOQRLNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-2-5-13(7-11-17)12-15-8-10-16-9-4-3-6-14(16)18/h3-4,6,9,13,15,17H,2,5,7-8,10-12H2,1H3.
What are the key properties of 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one?
1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one has a molecular weight of 252.36 g/mol, XLogP of 1.24, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-hydroxyethyl)pentylamino]ethyl]pyridin-2-one is sourced from PubChem (CID 114145307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).