N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide

C19H23N3O3 — CID 113013421

IUPACN-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide
SMILESCOc1cccc(CCNc2ccc(NC(=O)C3CCCO3)cn2)c1
InChIInChI=1S/C19H23N3O3/c1-24-16-5-2-4-14(12-16)9-10-20-18-8-7-15(13-21-18)22-19(23)17-6-3-11-25-17/h2,4-5,7-8,12-13,17H,3,6,9-11H2,1H3,(H,20,21)(H,22,23)
InChIKeyUKBMCVZSAUTRPQ-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.86
Rot. Bonds7

About N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide

N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide (PubChem CID 113013421) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide
PubChem CID113013421
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide
SMILESCOc1cccc(CCNc2ccc(NC(=O)C3CCCO3)cn2)c1
InChIInChI=1S/C19H23N3O3/c1-24-16-5-2-4-14(12-16)9-10-20-18-8-7-15(13-21-18)22-19(23)17-6-3-11-25-17/h2,4-5,7-8,12-13,17H,3,6,9-11H2,1H3,(H,20,21)(H,22,23)
InChIKeyUKBMCVZSAUTRPQ-UHFFFAOYSA-N
XLogP2.86
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113028392
(2R)-N-(3-methoxyphenyl)oxolane-2-carboxamide
CID 898392
N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]-2-methylpropanamide
CID 113013416
4-fluoro-N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]benzamide
CID 113013432
N-[6-(4-methoxyanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113019484
N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
CID 115268574
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113028252
N-[6-(3-methoxyanilino)pyridazin-3-yl]oxolane-2-carboxamide
CID 113048185
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
CID 104861065
N-[4-[2-(3-methoxyphenyl)ethylamino]phenyl]cyclopropanecarboxamide
CID 112983563
(2S)-N-(3,5-dimethoxyphenyl)oxolane-2-carboxamide
CID 9096652
2-chloro-6-fluoro-N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]benzamide
CID 113013450

Frequently Asked Questions

What is the IUPAC name of N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide?
The IUPAC name of N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide (CID 113013421) is N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide?
The canonical SMILES for N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide is COc1cccc(CCNc2ccc(NC(=O)C3CCCO3)cn2)c1.
What is the InChIKey of N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide?
The InChIKey is UKBMCVZSAUTRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-24-16-5-2-4-14(12-16)9-10-20-18-8-7-15(13-21-18)22-19(23)17-6-3-11-25-17/h2,4-5,7-8,12-13,17H,3,6,9-11H2,1H3,(H,20,21)(H,22,23).
What are the key properties of N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide?
N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.86, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 113013421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).