N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide

C15H17NO3S — CID 90523795

IUPACN-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide
SMILESO=C(NCCC(O)c1ccco1)C1(c2cccs2)CC1
InChIInChI=1S/C15H17NO3S/c17-11(12-3-1-9-19-12)5-8-16-14(18)15(6-7-15)13-4-2-10-20-13/h1-4,9-11,17H,5-8H2,(H,16,18)
InChIKeyPWQYWFGEZYOQPN-UHFFFAOYSA-N
MW291.37 g/mol
LogP2.61
Rot. Bonds6

About N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide

N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide (PubChem CID 90523795) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide
PubChem CID90523795
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC NameN-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide
SMILESO=C(NCCC(O)c1ccco1)C1(c2cccs2)CC1
InChIInChI=1S/C15H17NO3S/c17-11(12-3-1-9-19-12)5-8-16-14(18)15(6-7-15)13-4-2-10-20-13/h1-4,9-11,17H,5-8H2,(H,16,18)
InChIKeyPWQYWFGEZYOQPN-UHFFFAOYSA-N
XLogP2.61
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-3-phenylpropyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 71782253
N-[(3R)-3-hydroxy-3-phenylpropyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 97038575
N-[3-(2,5-dimethylfuran-3-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 121133140
N-[3-(dimethylamino)propyl]-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 110698443
N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 95986644
N-[3-(furan-2-yl)-3-hydroxypropyl]benzamide
CID 90523674
2-ethyl-N-[3-(furan-2-yl)-3-hydroxypropyl]butanamide
CID 90523672
N-[(2S)-3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 99872633
N-(2-morpholin-4-ium-4-ylethyl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243535
N-[2-[5-(furan-3-yl)thiophen-2-yl]ethyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 121019439
6-[(1-thiophen-2-ylcyclohexanecarbonyl)amino]hexanoic acid
CID 119220064
N'-tert-butyl-N-[3-(furan-2-yl)-3-hydroxypropyl]oxamide
CID 90523886

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide?
The IUPAC name of N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide (CID 90523795) is N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide?
The canonical SMILES for N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide is O=C(NCCC(O)c1ccco1)C1(c2cccs2)CC1.
What is the InChIKey of N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide?
The InChIKey is PWQYWFGEZYOQPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c17-11(12-3-1-9-19-12)5-8-16-14(18)15(6-7-15)13-4-2-10-20-13/h1-4,9-11,17H,5-8H2,(H,16,18).
What are the key properties of N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide?
N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide has a molecular weight of 291.37 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)-3-hydroxypropyl]-1-thiophen-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 90523795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).