N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide

C19H24N4O4 — CID 167988896

IUPACN-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide
SMILESCOCCOc1ccc(NC(=O)N2CCC(c3cc(OC)ccn3)C2)cn1
InChIInChI=1S/C19H24N4O4/c1-25-9-10-27-18-4-3-15(12-21-18)22-19(24)23-8-6-14(13-23)17-11-16(26-2)5-7-20-17/h3-5,7,11-12,14H,6,8-10,13H2,1-2H3,(H,22,24)
InChIKeyXZXVCIWEUGGTPS-UHFFFAOYSA-N
MW372.43 g/mol
LogP2.53
Rot. Bonds7

About N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide

N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide (PubChem CID 167988896) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide
PubChem CID167988896
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC NameN-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide
SMILESCOCCOc1ccc(NC(=O)N2CCC(c3cc(OC)ccn3)C2)cn1
InChIInChI=1S/C19H24N4O4/c1-25-9-10-27-18-4-3-15(12-21-18)22-19(24)23-8-6-14(13-23)17-11-16(26-2)5-7-20-17/h3-5,7,11-12,14H,6,8-10,13H2,1-2H3,(H,22,24)
InChIKeyXZXVCIWEUGGTPS-UHFFFAOYSA-N
XLogP2.53
TPSA85.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(3S)-3-N-[6-(2-methoxyethoxy)-3-pyridinyl]piperidine-1,3-dicarboxamide
CID 95158166
3-(1H-benzimidazol-2-yl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]piperidine-1-carboxamide
CID 47041579
N-[6-(3-methoxyphenoxy)-3-pyridinyl]-3-propoxypiperidine-1-carboxamide
CID 72846235
(3R)-N-[3-(2-methoxyethoxy)phenyl]-3-phenylpyrrolidine-1-carboxamide
CID 95592117
(3S)-3-acetamido-N-[6-(3-methoxyphenoxy)-3-pyridinyl]pyrrolidine-1-carboxamide
CID 97436990
3-(4-methoxy-2-pyridinyl)-N-[(5-methyl-4-oxo-6,7-dihydropyrazolo[1,5-a]pyrazin-3-yl)methyl]pyrrolidine-1-carboxamide
CID 166307482
N-[[6-(2-methoxyethoxy)-3-pyridinyl]methyl]-3-phenylpyrrolidine-1-carboxamide
CID 51128774
4-[(4-chlorophenyl)methyl]-N-[6-(2-methoxyethoxy)-3-pyridinyl]-1,4-diazepane-1-carboxamide
CID 55743349
4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)-N-(6-methoxy-3-pyridinyl)piperidine-1-carboxamide
CID 75479801
1-[3-(4-methoxy-2-pyridinyl)pyrrolidin-1-yl]-2-quinazolin-4-yloxyethanone
CID 166318304
(2S)-2-ethyl-N-(6-methoxy-3-pyridinyl)morpholine-4-carboxamide
CID 97097741
(3R)-3-(4-methoxyphenyl)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 94824028

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide (CID 167988896) is N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide is COCCOc1ccc(NC(=O)N2CCC(c3cc(OC)ccn3)C2)cn1.
What is the InChIKey of N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide?
The InChIKey is XZXVCIWEUGGTPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-25-9-10-27-18-4-3-15(12-21-18)22-19(24)23-8-6-14(13-23)17-11-16(26-2)5-7-20-17/h3-5,7,11-12,14H,6,8-10,13H2,1-2H3,(H,22,24).
What are the key properties of N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide?
N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxyethoxy)-3-pyridinyl]-3-(4-methoxy-2-pyridinyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 167988896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).