4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide

C15H22N2O3 — CID 62327297

IUPAC4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide
SMILESCCCOc1ccc(NC(=O)C2CC(OC)CN2)cc1
InChIInChI=1S/C15H22N2O3/c1-3-8-20-12-6-4-11(5-7-12)17-15(18)14-9-13(19-2)10-16-14/h4-7,13-14,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyYFPDWEWXHSIMCB-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.79
Rot. Bonds6

About 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide

4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide (PubChem CID 62327297) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide
PubChem CID62327297
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide
SMILESCCCOc1ccc(NC(=O)C2CC(OC)CN2)cc1
InChIInChI=1S/C15H22N2O3/c1-3-8-20-12-6-4-11(5-7-12)17-15(18)14-9-13(19-2)10-16-14/h4-7,13-14,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyYFPDWEWXHSIMCB-UHFFFAOYSA-N
XLogP1.79
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-butylphenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214462
4-methoxy-N-phenylpyrrolidine-2-carboxamide
CID 61213145
4-methoxy-N-(2-propoxyphenyl)pyrrolidine-2-carboxamide
CID 61214182
N-(4-carbamoylphenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214741
3-[4-[(4-methoxypyrrolidine-2-carbonyl)amino]phenyl]propanoic acid
CID 115339970
N-[4-(1,3-dioxolan-2-yl)phenyl]-4-methoxypyrrolidine-2-carboxamide
CID 106911790
4,4-difluoro-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 120955356
6-methyl-N-(4-propoxyphenyl)piperidine-2-carboxamide
CID 54855992
4-methoxy-N-(3,4,5-trifluorophenyl)pyrrolidine-2-carboxamide
CID 62813538
N-(3-iodophenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214459
N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide
CID 61213731
3-[2-[(4-methoxypyrrolidine-2-carbonyl)amino]phenyl]propanoic acid
CID 107273646

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide?
The IUPAC name of 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide (CID 62327297) is 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide is CCCOc1ccc(NC(=O)C2CC(OC)CN2)cc1.
What is the InChIKey of 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide?
The InChIKey is YFPDWEWXHSIMCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-3-8-20-12-6-4-11(5-7-12)17-15(18)14-9-13(19-2)10-16-14/h4-7,13-14,16H,3,8-10H2,1-2H3,(H,17,18).
What are the key properties of 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide?
4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 62327297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).