1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide

C20H22N2O3 — CID 91795536

IUPAC1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide
SMILESO=C(N[C@@H]1COCC[C@H]1Oc1ccccn1)C1(c2ccccc2)CC1
InChIInChI=1S/C20H22N2O3/c23-19(20(10-11-20)15-6-2-1-3-7-15)22-16-14-24-13-9-17(16)25-18-8-4-5-12-21-18/h1-8,12,16-17H,9-11,13-14H2,(H,22,23)/t16-,17-/m1/s1
InChIKeyXFNSNAFMOYAGBY-IAGOWNOFSA-N
MW338.41 g/mol
LogP2.47
Rot. Bonds5

About 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide

1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide (PubChem CID 91795536) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide
PubChem CID91795536
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide
SMILESO=C(N[C@@H]1COCC[C@H]1Oc1ccccn1)C1(c2ccccc2)CC1
InChIInChI=1S/C20H22N2O3/c23-19(20(10-11-20)15-6-2-1-3-7-15)22-16-14-24-13-9-17(16)25-18-8-4-5-12-21-18/h1-8,12,16-17H,9-11,13-14H2,(H,22,23)/t16-,17-/m1/s1
InChIKeyXFNSNAFMOYAGBY-IAGOWNOFSA-N
XLogP2.47
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

1-phenyl-N-[(3R,4R)-4-(pyridin-2-ylmethoxy)oxan-3-yl]cyclopropane-1-carboxamide
CID 91768818
N-[(3R,4S)-4-[(6-methyl-3-pyridinyl)oxy]oxan-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 91786809
1,1-di(propan-2-yl)-3-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]urea
CID 91777188
N-[2-oxo-2-[(4-pyridin-2-yloxyoxan-3-yl)amino]ethyl]benzamide
CID 156608743
2-phenylmethoxy-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]acetamide
CID 91761107
N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]-1H-pyrazole-4-carboxamide
CID 91773229
2-propan-2-ylsulfonyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]acetamide
CID 91766386
3-amino-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]thiophene-2-carboxamide
CID 91764238
3-(methanesulfonamido)-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]propanamide
CID 91792493
2-(dimethylamino)-4-methyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]pyrimidine-5-carboxamide
CID 91791524
2-methylsulfanyl-N-(4-pyridin-2-yloxyoxan-3-yl)-1,3-thiazole-4-carboxamide
CID 156608294
5-(methoxymethyl)-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]thiophene-2-carboxamide
CID 91798306

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide?
The IUPAC name of 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide (CID 91795536) is 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide is O=C(N[C@@H]1COCC[C@H]1Oc1ccccn1)C1(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide?
The InChIKey is XFNSNAFMOYAGBY-IAGOWNOFSA-N. The full InChI is InChI=1S/C20H22N2O3/c23-19(20(10-11-20)15-6-2-1-3-7-15)22-16-14-24-13-9-17(16)25-18-8-4-5-12-21-18/h1-8,12,16-17H,9-11,13-14H2,(H,22,23)/t16-,17-/m1/s1.
What are the key properties of 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide?
1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(3R,4R)-4-pyridin-2-yloxyoxan-3-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 91795536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).