N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide

C20H25N3O2 — CID 113030195

IUPACN-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide
SMILESCC(C)N(Cc1ccccc1)c1ccc(NC(=O)C2CCCO2)nc1
InChIInChI=1S/C20H25N3O2/c1-15(2)23(14-16-7-4-3-5-8-16)17-10-11-19(21-13-17)22-20(24)18-9-6-12-25-18/h3-5,7-8,10-11,13,15,18H,6,9,12,14H2,1-2H3,(H,21,22,24)
InChIKeySWVUGYYYCPNVQB-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.61
Rot. Bonds6

About N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide

N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide (PubChem CID 113030195) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide
PubChem CID113030195
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide
SMILESCC(C)N(Cc1ccccc1)c1ccc(NC(=O)C2CCCO2)nc1
InChIInChI=1S/C20H25N3O2/c1-15(2)23(14-16-7-4-3-5-8-16)17-10-11-19(21-13-17)22-20(24)18-9-6-12-25-18/h3-5,7-8,10-11,13,15,18H,6,9,12,14H2,1-2H3,(H,21,22,24)
InChIKeySWVUGYYYCPNVQB-UHFFFAOYSA-N
XLogP3.61
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[butyl(methyl)amino]-2-pyridinyl]oxolane-2-carboxamide
CID 113030509
N-[4-[benzyl(methyl)amino]phenyl]oxolane-2-carboxamide
CID 112982284
5-[benzyl(propan-2-yl)amino]-N-cyclopropylpyridine-2-carboxamide
CID 109179910
N-[5-(N-benzylanilino)-2-pyridinyl]oxane-4-carboxamide
CID 113035803
(2S)-N-(5-iodo-2-pyridinyl)oxolane-2-carboxamide
CID 103873257
(2S)-N-(5-bromo-2-pyridinyl)oxolane-2-carboxamide
CID 7346608
N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]oxolane-2-carboxamide
CID 113028796
(2R)-N-[4-[(N-[(2R)-oxolane-2-carbonyl]anilino)methyl]phenyl]oxolane-2-carboxamide
CID 95785400
(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide
CID 95635352
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113025707
N-[5-(N-benzylanilino)-2-pyridinyl]-2-methylpropanamide
CID 113035795
N-[5-(dimethylamino)-2-pyridinyl]-1-(oxolane-2-carbonyl)piperidine-2-carboxamide
CID 71878322

Frequently Asked Questions

What is the IUPAC name of N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide?
The IUPAC name of N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide (CID 113030195) is N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide?
The canonical SMILES for N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide is CC(C)N(Cc1ccccc1)c1ccc(NC(=O)C2CCCO2)nc1.
What is the InChIKey of N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide?
The InChIKey is SWVUGYYYCPNVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-15(2)23(14-16-7-4-3-5-8-16)17-10-11-19(21-13-17)22-20(24)18-9-6-12-25-18/h3-5,7-8,10-11,13,15,18H,6,9,12,14H2,1-2H3,(H,21,22,24).
What are the key properties of N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide?
N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 113030195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).