N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide

C14H18N4O2 — CID 57453610

IUPACN-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide
SMILESO=C(CCN1CCOCC1)Nc1n[nH]c2ccccc12
InChIInChI=1S/C14H18N4O2/c19-13(5-6-18-7-9-20-10-8-18)15-14-11-3-1-2-4-12(11)16-17-14/h1-4H,5-10H2,(H2,15,16,17,19)
InChIKeyJQVCLLKIHUEUFO-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.22
Rot. Bonds4

About N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide

N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide (PubChem CID 57453610) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide
PubChem CID57453610
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide
SMILESO=C(CCN1CCOCC1)Nc1n[nH]c2ccccc12
InChIInChI=1S/C14H18N4O2/c19-13(5-6-18-7-9-20-10-8-18)15-14-11-3-1-2-4-12(11)16-17-14/h1-4H,5-10H2,(H2,15,16,17,19)
InChIKeyJQVCLLKIHUEUFO-UHFFFAOYSA-N
XLogP1.22
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide?
The IUPAC name of N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide (CID 57453610) is N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide is O=C(CCN1CCOCC1)Nc1n[nH]c2ccccc12.
What is the InChIKey of N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide?
The InChIKey is JQVCLLKIHUEUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c19-13(5-6-18-7-9-20-10-8-18)15-14-11-3-1-2-4-12(11)16-17-14/h1-4H,5-10H2,(H2,15,16,17,19).
What are the key properties of N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide?
N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide has a molecular weight of 274.32 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-3-yl)-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 57453610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).