(3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide

C19H22N2O3 — CID 95046458

IUPAC(3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide
SMILESCOc1ccccc1CN(Cc1cccnc1)C(=O)[C@@H]1CCOC1
InChIInChI=1S/C19H22N2O3/c1-23-18-7-3-2-6-16(18)13-21(12-15-5-4-9-20-11-15)19(22)17-8-10-24-14-17/h2-7,9,11,17H,8,10,12-14H2,1H3/t17-/m1/s1
InChIKeyDKUBAFFKHAPZJY-QGZVFWFLSA-N
MW326.40 g/mol
LogP2.66
Rot. Bonds6

About (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide

(3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide (PubChem CID 95046458) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide
PubChem CID95046458
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name(3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide
SMILESCOc1ccccc1CN(Cc1cccnc1)C(=O)[C@@H]1CCOC1
InChIInChI=1S/C19H22N2O3/c1-23-18-7-3-2-6-16(18)13-21(12-15-5-4-9-20-11-15)19(22)17-8-10-24-14-17/h2-7,9,11,17H,8,10,12-14H2,1H3/t17-/m1/s1
InChIKeyDKUBAFFKHAPZJY-QGZVFWFLSA-N
XLogP2.66
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide (CID 95046458) is (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide is COc1ccccc1CN(Cc1cccnc1)C(=O)[C@@H]1CCOC1.
What is the InChIKey of (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide?
The InChIKey is DKUBAFFKHAPZJY-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-23-18-7-3-2-6-16(18)13-21(12-15-5-4-9-20-11-15)19(22)17-8-10-24-14-17/h2-7,9,11,17H,8,10,12-14H2,1H3/t17-/m1/s1.
What are the key properties of (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide?
(3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.66, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(2-methoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 95046458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).