5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide

C10H13ClN2O3 — CID 74883276

IUPAC5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide
SMILESCOC1CNCC1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C10H13ClN2O3/c1-15-8-5-12-4-6(8)13-10(14)7-2-3-9(11)16-7/h2-3,6,8,12H,4-5H2,1H3,(H,13,14)
InChIKeyDQJDMFCUKHVABF-UHFFFAOYSA-N
MW244.68 g/mol
LogP0.65
Rot. Bonds3

About 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide

5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide (PubChem CID 74883276) has the molecular formula C10H13ClN2O3 and a molecular weight of 244.68 g/mol. Its IUPAC name is 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide
PubChem CID74883276
Molecular FormulaC10H13ClN2O3
Molecular Weight244.68 g/mol
Exact Mass244.06
IUPAC Name5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide
SMILESCOC1CNCC1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C10H13ClN2O3/c1-15-8-5-12-4-6(8)13-10(14)7-2-3-9(11)16-7/h2-3,6,8,12H,4-5H2,1H3,(H,13,14)
InChIKeyDQJDMFCUKHVABF-UHFFFAOYSA-N
XLogP0.65
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.68
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dichloro-N-[(4S)-4-methoxypyrrolidin-3-yl]benzamide
CID 43594211
4,5-diethyl-N-[(4S)-4-methoxypyrrolidin-3-yl]furan-2-carboxamide;hydrochloride
CID 91660112
4-chloro-N-[(4S)-4-methoxypyrrolidin-3-yl]-3-methylbenzamide
CID 113304909
6-bromo-N-[(4S)-4-methoxypyrrolidin-3-yl]naphthalene-2-carboxamide
CID 115354184
N-[(4S)-4-methoxypyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide
CID 43594107
2-(3-chlorophenyl)-N-(4-methoxypyrrolidin-3-yl)acetamide;hydrochloride
CID 136561181
N-[(4S)-4-methoxypyrrolidin-3-yl]-2-pyridin-4-ylacetamide
CID 43594044
2-bromo-N-[(4S)-4-methoxypyrrolidin-3-yl]-3-methylbenzamide
CID 113357096
N-(4-methoxypyrrolidin-3-yl)-1H-pyrazole-4-carboxamide
CID 74883497
N-[(3S,4S)-4-methoxypyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 93205481
N-[(4S)-4-methoxypyrrolidin-3-yl]-1-methylpyrazole-4-carboxamide
CID 43594183
N-[(4S)-4-methoxypyrrolidin-3-yl]naphthalene-2-carboxamide
CID 43594014

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide?
The IUPAC name of 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide (CID 74883276) is 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide is COC1CNCC1NC(=O)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide?
The InChIKey is DQJDMFCUKHVABF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O3/c1-15-8-5-12-4-6(8)13-10(14)7-2-3-9(11)16-7/h2-3,6,8,12H,4-5H2,1H3,(H,13,14).
What are the key properties of 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide?
5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide has a molecular weight of 244.68 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-methoxypyrrolidin-3-yl)furan-2-carboxamide is sourced from PubChem (CID 74883276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).