N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide

C11H18N4O2 — CID 61213731

IUPACN-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide
SMILESCCn1cc(NC(=O)C2CC(OC)CN2)cn1
InChIInChI=1S/C11H18N4O2/c1-3-15-7-8(5-13-15)14-11(16)10-4-9(17-2)6-12-10/h5,7,9-10,12H,3-4,6H2,1-2H3,(H,14,16)
InChIKeyMBKDTNINODHAAJ-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.22
Rot. Bonds4

About N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide

N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide (PubChem CID 61213731) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide
PubChem CID61213731
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC NameN-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide
SMILESCCn1cc(NC(=O)C2CC(OC)CN2)cn1
InChIInChI=1S/C11H18N4O2/c1-3-15-7-8(5-13-15)14-11(16)10-4-9(17-2)6-12-10/h5,7,9-10,12H,3-4,6H2,1-2H3,(H,14,16)
InChIKeyMBKDTNINODHAAJ-UHFFFAOYSA-N
XLogP0.22
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61214194
(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119292192
4-methoxy-N-phenylpyrrolidine-2-carboxamide
CID 61213145
4-methoxy-N-(1,2-oxazol-4-yl)pyrrolidine-2-carboxamide
CID 62902745
N-(4-butylphenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214462
4-methoxy-N-(4-propoxyphenyl)pyrrolidine-2-carboxamide
CID 62327297
1-[(1-ethylpyrazol-4-yl)carbamoyl]-4-methoxypyrrolidine-2-carboxylic acid
CID 61209916
4-methoxy-N-(3,4,5-trifluorophenyl)pyrrolidine-2-carboxamide
CID 62813538
4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 63327667
N-(1-ethylpyrazol-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76893175
4-methoxy-N-(2-methylphenyl)pyrrolidine-2-carboxamide
CID 61214161
(1S,2S,4S)-N-(1-ethylpyrazol-4-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 100569266

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide (CID 61213731) is N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide is CCn1cc(NC(=O)C2CC(OC)CN2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide?
The InChIKey is MBKDTNINODHAAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-3-15-7-8(5-13-15)14-11(16)10-4-9(17-2)6-12-10/h5,7,9-10,12H,3-4,6H2,1-2H3,(H,14,16).
What are the key properties of N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide?
N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide is sourced from PubChem (CID 61213731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).