N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide

C15H23N3O2 — CID 113030509

IUPACN-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide
SMILESCCCCN(C)c1ccc(NC(=O)C2CCCO2)nc1
InChIInChI=1S/C15H23N3O2/c1-3-4-9-18(2)12-7-8-14(16-11-12)17-15(19)13-6-5-10-20-13/h7-8,11,13H,3-6,9-10H2,1-2H3,(H,16,17,19)
InChIKeyYCNOLNBPXGBTES-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.44
Rot. Bonds6

About N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide

N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide (PubChem CID 113030509) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide
PubChem CID113030509
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide
SMILESCCCCN(C)c1ccc(NC(=O)C2CCCO2)nc1
InChIInChI=1S/C15H23N3O2/c1-3-4-9-18(2)12-7-8-14(16-11-12)17-15(19)13-6-5-10-20-13/h7-8,11,13H,3-6,9-10H2,1-2H3,(H,16,17,19)
InChIKeyYCNOLNBPXGBTES-UHFFFAOYSA-N
XLogP2.44
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[butyl(methyl)amino]-2-pyridinyl]cyclopropanecarboxamide
CID 113030505
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113025707
N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide
CID 113030195
(2S)-N-(5-iodo-2-pyridinyl)oxolane-2-carboxamide
CID 103873257
(2S)-N-(5-bromo-2-pyridinyl)oxolane-2-carboxamide
CID 7346608
N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
CID 115268574
N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide
CID 71878322
N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129000728
(2S,3S)-N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129400783
N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
CID 113030095
N-[6-(diethylamino)pyridazin-3-yl]oxolane-2-carboxamide
CID 113043959
(2S)-N-[4-(dimethylamino)phenyl]oxolane-2-carboxamide
CID 40572409

Frequently Asked Questions

What is the IUPAC name of N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide?
The IUPAC name of N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide (CID 113030509) is N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide?
The canonical SMILES for N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide is CCCCN(C)c1ccc(NC(=O)C2CCCO2)nc1.
What is the InChIKey of N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide?
The InChIKey is YCNOLNBPXGBTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-4-9-18(2)12-7-8-14(16-11-12)17-15(19)13-6-5-10-20-13/h7-8,11,13H,3-6,9-10H2,1-2H3,(H,16,17,19).
What are the key properties of N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide?
N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 113030509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).