1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide

C18H24N4O2 — CID 119532334

IUPAC1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide
SMILESCCCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)C1CCNC1
InChIInChI=1S/C18H24N4O2/c1-3-11-21(15-8-10-19-13-15)18(23)17-9-12-22(20-17)14-4-6-16(24-2)7-5-14/h4-7,9,12,15,19H,3,8,10-11,13H2,1-2H3
InChIKeyIDFWYYPWMOHUHQ-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.10
Rot. Bonds6

About 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide

1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide (PubChem CID 119532334) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide
PubChem CID119532334
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide
SMILESCCCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)C1CCNC1
InChIInChI=1S/C18H24N4O2/c1-3-11-21(15-8-10-19-13-15)18(23)17-9-12-22(20-17)14-4-6-16(24-2)7-5-14/h4-7,9,12,15,19H,3,8,10-11,13H2,1-2H3
InChIKeyIDFWYYPWMOHUHQ-UHFFFAOYSA-N
XLogP2.10
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-1-(4-fluorophenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide;hydrochloride
CID 119532306
2-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 60807367
1-(4-methylphenyl)-N-propyl-N-pyrrolidin-3-yltriazole-4-carboxamide;hydrochloride
CID 119530408
3-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119533031
1-(4-methoxyphenyl)-N-(2-pyrrolidin-3-ylethyl)pyrazole-3-carboxamide;hydrochloride
CID 119537008
2-bromo-5-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 63300965
2-bromo-5-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119529988
4-hydroxy-1-phenyl-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide;hydrochloride
CID 119529856
2-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119531891
2-(4-methoxyphenoxy)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532521
N-propyl-N-pyrrolidin-3-yl-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 119532441
3-methoxy-N-propyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
CID 81119139

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide (CID 119532334) is 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide is CCCN(C(=O)c1ccn(-c2ccc(OC)cc2)n1)C1CCNC1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide?
The InChIKey is IDFWYYPWMOHUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-3-11-21(15-8-10-19-13-15)18(23)17-9-12-22(20-17)14-4-6-16(24-2)7-5-14/h4-7,9,12,15,19H,3,8,10-11,13H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide?
1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylpyrazole-3-carboxamide is sourced from PubChem (CID 119532334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).