cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide

C20H23NO2 — CID 97020917

IUPACcis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide
SMILESC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccco1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C20H23NO2/c1-13(15-9-8-14-5-2-3-6-16(14)11-15)21-20(22)18-12-17(18)19-7-4-10-23-19/h4,7-11,13,17-18H,2-3,5-6,12H2,1H3,(H,21,22)/t13-,17-,18+/m0/s1
InChIKeyGOOFIQYVTAQVSG-DOPJRALCSA-N
MW309.41 g/mol
LogP4.14
Rot. Bonds4

About cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide

cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide (PubChem CID 97020917) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide
PubChem CID97020917
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Namecis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide
SMILESC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccco1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C20H23NO2/c1-13(15-9-8-14-5-2-3-6-16(14)11-15)21-20(22)18-12-17(18)19-7-4-10-23-19/h4,7-11,13,17-18H,2-3,5-6,12H2,1H3,(H,21,22)/t13-,17-,18+/m0/s1
InChIKeyGOOFIQYVTAQVSG-DOPJRALCSA-N
XLogP4.14
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2S)-2-methyl-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide
CID 31442780
6-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 45331244
2-[[(1R)-1-(furan-2-yl)ethyl]amino]-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]acetamide
CID 8921633
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]urea
CID 110893540
N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclohexanecarboxamide
CID 127109666
N-[(1S)-1-(2,3-dihydro-1H-inden-5-yl)ethyl]cyclopropanecarboxamide
CID 94487664
2-methyl-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]pyrrolidine-3-carboxamide
CID 79378615
(3R)-1-(furan-2-carbonyl)-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]piperidine-3-carboxamide
CID 32621933
(3S)-1-(furan-2-carbonyl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]piperidine-3-carboxamide
CID 32621939
(2R)-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]oxolane-2-carboxamide
CID 35367348
N-[2-oxo-2-[[2-oxo-2-[[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]amino]ethyl]amino]ethyl]furan-2-carboxamide
CID 9396624
N-[2-oxo-2-[[2-oxo-2-[[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]amino]ethyl]amino]ethyl]furan-2-carboxamide
CID 9396618

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide?
The IUPAC name of cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide (CID 97020917) is cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide?
The canonical SMILES for cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide is C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccco1)c1ccc2c(c1)CCCC2.
What is the InChIKey of cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide?
The InChIKey is GOOFIQYVTAQVSG-DOPJRALCSA-N. The full InChI is InChI=1S/C20H23NO2/c1-13(15-9-8-14-5-2-3-6-16(14)11-15)21-20(22)18-12-17(18)19-7-4-10-23-19/h4,7-11,13,17-18H,2-3,5-6,12H2,1H3,(H,21,22)/t13-,17-,18+/m0/s1.
What are the key properties of cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide?
cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-(furan-2-yl)-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 97020917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).