4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide

C12H20N4O2 — CID 65358909

IUPAC4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)NC1CCCC1OC
InChIInChI=1S/C12H20N4O2/c1-3-16-11(8(13)7-14-16)12(17)15-9-5-4-6-10(9)18-2/h7,9-10H,3-6,13H2,1-2H3,(H,15,17)
InChIKeyLNUYNHRCRAGJAE-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.78
Rot. Bonds4

About 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide

4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide (PubChem CID 65358909) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide
PubChem CID65358909
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)NC1CCCC1OC
InChIInChI=1S/C12H20N4O2/c1-3-16-11(8(13)7-14-16)12(17)15-9-5-4-6-10(9)18-2/h7,9-10H,3-6,13H2,1-2H3,(H,15,17)
InChIKeyLNUYNHRCRAGJAE-UHFFFAOYSA-N
XLogP0.78
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide (CID 65358909) is 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide is CCn1ncc(N)c1C(=O)NC1CCCC1OC.
What is the InChIKey of 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide?
The InChIKey is LNUYNHRCRAGJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-16-11(8(13)7-14-16)12(17)15-9-5-4-6-10(9)18-2/h7,9-10H,3-6,13H2,1-2H3,(H,15,17).
What are the key properties of 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide?
4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-5-carboxamide is sourced from PubChem (CID 65358909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).