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

C10H16N4O2 — CID 43577016

IUPACN-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide
SMILESCC(C(=O)N(CCO)C1CC1)n1cncn1
InChIInChI=1S/C10H16N4O2/c1-8(14-7-11-6-12-14)10(16)13(4-5-15)9-2-3-9/h6-9,15H,2-5H2,1H3
InChIKeyHXNMUNBMOLCYDV-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.18
Rot. Bonds5

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

N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide (PubChem CID 43577016) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide
PubChem CID43577016
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC NameN-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide
SMILESCC(C(=O)N(CCO)C1CC1)n1cncn1
InChIInChI=1S/C10H16N4O2/c1-8(14-7-11-6-12-14)10(16)13(4-5-15)9-2-3-9/h6-9,15H,2-5H2,1H3
InChIKeyHXNMUNBMOLCYDV-UHFFFAOYSA-N
XLogP-0.18
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide?
The IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide (CID 43577016) is N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide?
The canonical SMILES for N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide is CC(C(=O)N(CCO)C1CC1)n1cncn1.
What is the InChIKey of N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide?
The InChIKey is HXNMUNBMOLCYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-8(14-7-11-6-12-14)10(16)13(4-5-15)9-2-3-9/h6-9,15H,2-5H2,1H3.
What are the key properties of N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide?
N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide has a molecular weight of 224.26 g/mol, XLogP of -0.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-hydroxyethyl)-2-(1,2,4-triazol-1-yl)propanamide is sourced from PubChem (CID 43577016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).