[3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone

C11H16N2O2 — CID 81466961

IUPAC[3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone
SMILESCNC1CCN(C(=O)c2ccc(C)o2)C1
InChIInChI=1S/C11H16N2O2/c1-8-3-4-10(15-8)11(14)13-6-5-9(7-13)12-2/h3-4,9,12H,5-7H2,1-2H3
InChIKeyIYUZHHPXUBUOQP-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.02
Rot. Bonds2

About [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone

[3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone (PubChem CID 81466961) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone.

Molecular Properties

Compound Name[3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone
PubChem CID81466961
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name[3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone
SMILESCNC1CCN(C(=O)c2ccc(C)o2)C1
InChIInChI=1S/C11H16N2O2/c1-8-3-4-10(15-8)11(14)13-6-5-9(7-13)12-2/h3-4,9,12H,5-7H2,1-2H3
InChIKeyIYUZHHPXUBUOQP-UHFFFAOYSA-N
XLogP1.02
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methoxypyrrolidin-1-yl)-(5-methylfuran-2-yl)methanone
CID 108730619
N-[1-(5-methylfuran-2-carbonyl)piperidin-3-yl]methanesulfonamide
CID 47184451
(4-bromopiperidin-1-yl)-(5-methylfuran-2-yl)methanone
CID 80661568
[3-(2-chloroethyl)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone
CID 114801301
(5-chlorofuran-2-yl)-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119492575
(5-bromofuran-2-yl)-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119488242
(5-bromofuran-2-yl)-[4-(methylamino)piperidin-1-yl]methanone
CID 119560232
[3-(methylamino)pyrrolidin-1-yl]-(4-methylphenyl)methanone
CID 81467156
(5-bromofuran-2-yl)-[4-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119560231
N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide
CID 119493697
N-[[(1S,3aR,7aR)-5-(5-methylfuran-2-carbonyl)-3,3a,4,6,7,7a-hexahydro-1H-furo[3,4-c]pyridin-1-yl]methyl]methanesulfonamide
CID 97461784
[3-(methylamino)piperidin-1-yl]-(5-nitrofuran-2-yl)methanone;hydrochloride
CID 119489082

Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone?
The IUPAC name of [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone (CID 81466961) is [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone.
What is the SMILES notation for [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone?
The canonical SMILES for [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone is CNC1CCN(C(=O)c2ccc(C)o2)C1.
What is the InChIKey of [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone?
The InChIKey is IYUZHHPXUBUOQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8-3-4-10(15-8)11(14)13-6-5-9(7-13)12-2/h3-4,9,12H,5-7H2,1-2H3.
What are the key properties of [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone?
[3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone has a molecular weight of 208.26 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone is sourced from PubChem (CID 81466961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).