4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one

C14H22N2O2 — CID 55152176

IUPAC4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one
SMILESCc1ccn(CCNC(C)C2CCCO2)c(=O)c1
InChIInChI=1S/C14H22N2O2/c1-11-5-7-16(14(17)10-11)8-6-15-12(2)13-4-3-9-18-13/h5,7,10,12-13,15H,3-4,6,8-9H2,1-2H3
InChIKeyUQPWWXVUXHXZML-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.31
Rot. Bonds5

About 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one

4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one (PubChem CID 55152176) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one.

Molecular Properties

Compound Name4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one
PubChem CID55152176
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one
SMILESCc1ccn(CCNC(C)C2CCCO2)c(=O)c1
InChIInChI=1S/C14H22N2O2/c1-11-5-7-16(14(17)10-11)8-6-15-12(2)13-4-3-9-18-13/h5,7,10,12-13,15H,3-4,6,8-9H2,1-2H3
InChIKeyUQPWWXVUXHXZML-UHFFFAOYSA-N
XLogP1.31
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(oxolan-2-yl)ethyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 45812380
2-oxo-N-[1-(oxolan-2-yl)ethyl]-1H-pyridine-3-carboxamide
CID 47282701
1-methyl-6-oxo-N-[1-(oxolan-2-yl)propyl]pyridine-3-carboxamide
CID 71909373
N,4-dimethyl-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-2-carboxamide
CID 137975772
N-[[(2R)-oxolan-2-yl]methyl]-2-[2-oxo-4-(trifluoromethyl)-1-pyridinyl]acetamide
CID 164637207
N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 35233902
N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 35233907
N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 35233912
N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 35233917
N'-[1-(oxolan-2-yl)ethyl]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]oxamide
CID 53572640
1-[2-[1-(Oxolan-2-yl)ethylamino]ethyl]-5-(trifluoromethyl)pyridin-2-one
CID 63280129
1-[2-[1-(Oxolan-2-yl)ethylamino]ethyl]-6-(trifluoromethyl)pyridin-2-one
CID 81310745

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one?
The IUPAC name of 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one (CID 55152176) is 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one.
What is the SMILES notation for 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one?
The canonical SMILES for 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one is Cc1ccn(CCNC(C)C2CCCO2)c(=O)c1.
What is the InChIKey of 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one?
The InChIKey is UQPWWXVUXHXZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-5-7-16(14(17)10-11)8-6-15-12(2)13-4-3-9-18-13/h5,7,10,12-13,15H,3-4,6,8-9H2,1-2H3.
What are the key properties of 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one?
4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one has a molecular weight of 250.34 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridin-2-one is sourced from PubChem (CID 55152176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).