N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide

C20H22N2O3 — CID 26009670

IUPACN-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide
SMILESO=C(NC[C@H](c1ccco1)N1CCCC1)C1=Cc2ccccc2OC1
InChIInChI=1S/C20H22N2O3/c23-20(16-12-15-6-1-2-7-18(15)25-14-16)21-13-17(19-8-5-11-24-19)22-9-3-4-10-22/h1-2,5-8,11-12,17H,3-4,9-10,13-14H2,(H,21,23)/t17-/m1/s1
InChIKeyIFPMFURUCVQUKX-QGZVFWFLSA-N
MW338.41 g/mol
LogP3.01
Rot. Bonds5

About N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide

N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide (PubChem CID 26009670) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide
PubChem CID26009670
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide
SMILESO=C(NC[C@H](c1ccco1)N1CCCC1)C1=Cc2ccccc2OC1
InChIInChI=1S/C20H22N2O3/c23-20(16-12-15-6-1-2-7-18(15)25-14-16)21-13-17(19-8-5-11-24-19)22-9-3-4-10-22/h1-2,5-8,11-12,17H,3-4,9-10,13-14H2,(H,21,23)/t17-/m1/s1
InChIKeyIFPMFURUCVQUKX-QGZVFWFLSA-N
XLogP3.01
TPSA54.71 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 ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide;hydrochloride
CID 52985069
4-bromo-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 7944545
4-chloro-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 4877480
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 34669940
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-1,3-benzodioxole-5-carboxamide
CID 4780259
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-methylbenzamide
CID 43842816
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-(trifluoromethyl)benzamide
CID 4807708
2-fluoro-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 26834331
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide
CID 4883742
3,4-dichloro-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 7972696
N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]naphthalene-1-carboxamide
CID 26834307
4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 24542498

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide?
The IUPAC name of N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide (CID 26009670) is N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide?
The canonical SMILES for N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide is O=C(NC[C@H](c1ccco1)N1CCCC1)C1=Cc2ccccc2OC1.
What is the InChIKey of N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide?
The InChIKey is IFPMFURUCVQUKX-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H22N2O3/c23-20(16-12-15-6-1-2-7-18(15)25-14-16)21-13-17(19-8-5-11-24-19)22-9-3-4-10-22/h1-2,5-8,11-12,17H,3-4,9-10,13-14H2,(H,21,23)/t17-/m1/s1.
What are the key properties of N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide?
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2H-chromene-3-carboxamide is sourced from PubChem (CID 26009670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).