N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide

C14H18N4OS — CID 60931705

IUPACN-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide
SMILESCC(Nc1cnn(CC(=O)NC2CC2)c1)c1cccs1
InChIInChI=1S/C14H18N4OS/c1-10(13-3-2-6-20-13)16-12-7-15-18(8-12)9-14(19)17-11-4-5-11/h2-3,6-8,10-11,16H,4-5,9H2,1H3,(H,17,19)
InChIKeyHIBDYWOXDVDFON-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.40
Rot. Bonds6

About N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide

N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide (PubChem CID 60931705) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide
PubChem CID60931705
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC NameN-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide
SMILESCC(Nc1cnn(CC(=O)NC2CC2)c1)c1cccs1
InChIInChI=1S/C14H18N4OS/c1-10(13-3-2-6-20-13)16-12-7-15-18(8-12)9-14(19)17-11-4-5-11/h2-3,6-8,10-11,16H,4-5,9H2,1H3,(H,17,19)
InChIKeyHIBDYWOXDVDFON-UHFFFAOYSA-N
XLogP2.40
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide (CID 60931705) is N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide is CC(Nc1cnn(CC(=O)NC2CC2)c1)c1cccs1.
What is the InChIKey of N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide?
The InChIKey is HIBDYWOXDVDFON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-10(13-3-2-6-20-13)16-12-7-15-18(8-12)9-14(19)17-11-4-5-11/h2-3,6-8,10-11,16H,4-5,9H2,1H3,(H,17,19).
What are the key properties of N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide?
N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide has a molecular weight of 290.39 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(1-thiophen-2-ylethylamino)pyrazol-1-yl]acetamide is sourced from PubChem (CID 60931705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).