(3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide

C14H22N2O3 — CID 126449674

IUPAC(3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide
SMILESCCCOC[C@@H]1CCN(C(=O)NCc2ccoc2)C1
InChIInChI=1S/C14H22N2O3/c1-2-6-18-11-13-3-5-16(9-13)14(17)15-8-12-4-7-19-10-12/h4,7,10,13H,2-3,5-6,8-9,11H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyYXZJNKBEVGQTEL-CYBMUJFWSA-N
MW266.34 g/mol
LogP2.24
Rot. Bonds6

About (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide

(3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide (PubChem CID 126449674) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide
PubChem CID126449674
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name(3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide
SMILESCCCOC[C@@H]1CCN(C(=O)NCc2ccoc2)C1
InChIInChI=1S/C14H22N2O3/c1-2-6-18-11-13-3-5-16(9-13)14(17)15-8-12-4-7-19-10-12/h4,7,10,13H,2-3,5-6,8-9,11H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyYXZJNKBEVGQTEL-CYBMUJFWSA-N
XLogP2.24
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(3R)-N-(furan-3-ylmethyl)-3-[methyl(pyrimidin-2-ylmethyl)amino]pyrrolidine-1-carboxamide
CID 129339458
methyl 3-chloro-4-[[3-(propoxymethyl)pyrrolidine-1-carbonyl]amino]benzoate
CID 72914454
N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-3-(propoxymethyl)pyrrolidine-1-carboxamide
CID 137025280
N-butyl-4-[[[C-[3-(2-methoxyethoxymethyl)pyrrolidin-1-yl]-N-methylcarbonimidoyl]amino]methyl]benzamide
CID 111747611
1-(1-ethylpyrrolidin-3-yl)-N-(furan-3-ylmethyl)methanamine
CID 63001258
(3S)-3-(ethoxymethyl)-N-[(3-fluoro-2-pyridinyl)methyl]pyrrolidine-1-carboxamide
CID 97240765
3-(ethoxymethyl)-N-[(3-methylimidazol-4-yl)methyl]pyrrolidine-1-carboxamide
CID 139004590
1-[4-(furan-3-ylmethylamino)piperidin-1-yl]ethanone
CID 60979868
1-ethyl-6-methyl-3-[(3R)-3-(propoxymethyl)pyrrolidine-1-carbonyl]pyridin-2-one
CID 126448084
N-[(4-fluorophenyl)methyl]-3-(2-methoxyethoxymethyl)-N'-methylpyrrolidine-1-carboximidamide
CID 111746011
2-(1,4-dimethylpiperazin-2-yl)-N-(furan-3-ylmethyl)acetamide
CID 91829648
(3R)-3-(ethoxymethyl)-N-[[4-[(2-oxo-1-pyridinyl)methyl]phenyl]methyl]piperidine-1-carboxamide
CID 97316982

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide?
The IUPAC name of (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide (CID 126449674) is (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide is CCCOC[C@@H]1CCN(C(=O)NCc2ccoc2)C1.
What is the InChIKey of (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide?
The InChIKey is YXZJNKBEVGQTEL-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-2-6-18-11-13-3-5-16(9-13)14(17)15-8-12-4-7-19-10-12/h4,7,10,13H,2-3,5-6,8-9,11H2,1H3,(H,15,17)/t13-/m1/s1.
What are the key properties of (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide?
(3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(furan-3-ylmethyl)-3-(propoxymethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 126449674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).