N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide

C10H16N4O2 — CID 81444580

IUPACN-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide
SMILESCC(O)c1cn(C(C)C(=O)NC2CC2)nn1
InChIInChI=1S/C10H16N4O2/c1-6(10(16)11-8-3-4-8)14-5-9(7(2)15)12-13-14/h5-8,15H,3-4H2,1-2H3,(H,11,16)
InChIKeyJVGZENQCCVLGOV-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.17
Rot. Bonds4

About N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide

N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide (PubChem CID 81444580) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide
PubChem CID81444580
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC NameN-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide
SMILESCC(O)c1cn(C(C)C(=O)NC2CC2)nn1
InChIInChI=1S/C10H16N4O2/c1-6(10(16)11-8-3-4-8)14-5-9(7(2)15)12-13-14/h5-8,15H,3-4H2,1-2H3,(H,11,16)
InChIKeyJVGZENQCCVLGOV-UHFFFAOYSA-N
XLogP0.17
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[(1S)-1-hydroxyethyl]triazol-1-yl]-N-methylpropanamide
CID 130567345
methyl 1-[1-(cyclopropylamino)-1-oxopropan-2-yl]triazole-4-carboxylate
CID 103107694
N-cyclopropyl-2-[4-(2,2,2-trifluoroacetyl)triazol-1-yl]propanamide
CID 55092258
2-[4-(1-hydroxyethyl)triazol-1-yl]-N-pentan-2-ylpropanamide
CID 81444584
N-cyclohexyl-2-[4-(hydroxymethyl)triazol-1-yl]propanamide
CID 62401094
2-[4-(1-hydroxyethyl)triazol-1-yl]-N,N-dimethylpropanamide
CID 81444021
N-cyclopentyl-2-[4-[(propan-2-ylamino)methyl]triazol-1-yl]propanamide
CID 66194152
2-(4-bromo-3-methylpyrazol-1-yl)-N-cyclopropylpropanamide
CID 19533335
(1S)-1-(1-propan-2-yltriazol-4-yl)ethanol
CID 124596958
1-[1-(1-iodoethyl)triazol-4-yl]ethanol
CID 170178991
2-(4-bromopyrazol-1-yl)-N-cyclooctylpropanamide
CID 154834581
2-(4-bromo-3-methylpyrazol-1-yl)-N-cyclooctylpropanamide
CID 45125859

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide (CID 81444580) is N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide is CC(O)c1cn(C(C)C(=O)NC2CC2)nn1.
What is the InChIKey of N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide?
The InChIKey is JVGZENQCCVLGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-6(10(16)11-8-3-4-8)14-5-9(7(2)15)12-13-14/h5-8,15H,3-4H2,1-2H3,(H,11,16).
What are the key properties of N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide?
N-cyclopropyl-2-[4-(1-hydroxyethyl)triazol-1-yl]propanamide has a molecular weight of 224.26 g/mol, XLogP of 0.17, 4 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-hydroxyethyl)triazol-1-yl]propanamide is sourced from PubChem (CID 81444580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).