cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide

C20H18N2O3 — CID 97003815

IUPACcis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccco2)ccc1Oc1cccnc1
InChIInChI=1S/C20H18N2O3/c1-13-10-14(6-7-18(13)25-15-4-2-8-21-12-15)22-20(23)17-11-16(17)19-5-3-9-24-19/h2-10,12,16-17H,11H2,1H3,(H,22,23)/t16-,17+/m0/s1
InChIKeyANDYBGMUYRVSHD-DLBZAZTESA-N
MW334.38 g/mol
LogP4.52
Rot. Bonds5

About cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide

cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide (PubChem CID 97003815) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide
PubChem CID97003815
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Namecis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccco2)ccc1Oc1cccnc1
InChIInChI=1S/C20H18N2O3/c1-13-10-14(6-7-18(13)25-15-4-2-8-21-12-15)22-20(23)17-11-16(17)19-5-3-9-24-19/h2-10,12,16-17H,11H2,1H3,(H,22,23)/t16-,17+/m0/s1
InChIKeyANDYBGMUYRVSHD-DLBZAZTESA-N
XLogP4.52
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide with MolForge

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Related Compounds

(1R,2R,3S,4R)-3-[(3-methyl-4-pyridin-3-yloxyphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 124809901
(2S)-N-(3-methyl-4-pyridin-3-yloxyphenyl)pyrrolidine-2-carboxamide
CID 100663215
N-(3-acetamido-4-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86851825
N-(3-methyl-4-pyridin-3-yloxyphenyl)morpholine-3-carboxamide;dihydrochloride
CID 119864469
(2S,5R)-5-(aminomethyl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)oxolane-2-carboxamide;dihydrochloride
CID 120799083
N-(4-ethoxy-3-fluorophenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86851939
N-(3-methyl-4-pyridin-3-yloxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 60581044
ethyl N-[4-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]phenyl]carbamate
CID 86851812
1-amino-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopentane-1-carboxamide;dihydrochloride
CID 119864481
N-(3-methyl-4-pyridin-3-yloxyphenyl)-3-phenylprop-2-ynamide
CID 166220719
N-(4-chloro-2-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 47449751
3-(4-methylphenyl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)propanamide
CID 60581343

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide (CID 97003815) is cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide is Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccco2)ccc1Oc1cccnc1.
What is the InChIKey of cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is ANDYBGMUYRVSHD-DLBZAZTESA-N. The full InChI is InChI=1S/C20H18N2O3/c1-13-10-14(6-7-18(13)25-15-4-2-8-21-12-15)22-20(23)17-11-16(17)19-5-3-9-24-19/h2-10,12,16-17H,11H2,1H3,(H,22,23)/t16-,17+/m0/s1.
What are the key properties of cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide?
cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-(furan-2-yl)-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 97003815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).