N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide

C18H25N3O2 — CID 69431824

IUPACN-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide
SMILESCCC(=O)N[C@@H]1CCC[C@H](Oc2ccc3[nH]ncc3c2CC)C1
InChIInChI=1S/C18H25N3O2/c1-3-14-15-11-19-21-16(15)8-9-17(14)23-13-7-5-6-12(10-13)20-18(22)4-2/h8-9,11-13H,3-7,10H2,1-2H3,(H,19,21)(H,20,22)/t12-,13+/m1/s1
InChIKeyWZZYQTJWFMZFQQ-OLZOCXBDSA-N
MW315.42 g/mol
LogP3.34
Rot. Bonds5

About N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide

N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide (PubChem CID 69431824) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide.

Molecular Properties

Compound NameN-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide
PubChem CID69431824
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide
SMILESCCC(=O)N[C@@H]1CCC[C@H](Oc2ccc3[nH]ncc3c2CC)C1
InChIInChI=1S/C18H25N3O2/c1-3-14-15-11-19-21-16(15)8-9-17(14)23-13-7-5-6-12(10-13)20-18(22)4-2/h8-9,11-13H,3-7,10H2,1-2H3,(H,19,21)(H,20,22)/t12-,13+/m1/s1
InChIKeyWZZYQTJWFMZFQQ-OLZOCXBDSA-N
XLogP3.34
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide?
The IUPAC name of N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide (CID 69431824) is N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide.
What is the SMILES notation for N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide?
The canonical SMILES for N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide is CCC(=O)N[C@@H]1CCC[C@H](Oc2ccc3[nH]ncc3c2CC)C1.
What is the InChIKey of N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide?
The InChIKey is WZZYQTJWFMZFQQ-OLZOCXBDSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-3-14-15-11-19-21-16(15)8-9-17(14)23-13-7-5-6-12(10-13)20-18(22)4-2/h8-9,11-13H,3-7,10H2,1-2H3,(H,19,21)(H,20,22)/t12-,13+/m1/s1.
What are the key properties of N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide?
N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide has a molecular weight of 315.42 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,3S)-3-[(4-ethyl-1H-indazol-5-yl)oxy]cyclohexyl]propanamide is sourced from PubChem (CID 69431824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).