N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine

C10H17N3O — CID 43776920

IUPACN-(2-methoxycyclohexyl)-1H-pyrazol-4-amine
SMILESCOC1CCCCC1Nc1cn[nH]c1
InChIInChI=1S/C10H17N3O/c1-14-10-5-3-2-4-9(10)13-8-6-11-12-7-8/h6-7,9-10,13H,2-5H2,1H3,(H,11,12)
InChIKeyYDPQUCYIZCGLQK-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.78
Rot. Bonds3

About N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine

N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine (PubChem CID 43776920) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine.

Molecular Properties

Compound NameN-(2-methoxycyclohexyl)-1H-pyrazol-4-amine
PubChem CID43776920
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-(2-methoxycyclohexyl)-1H-pyrazol-4-amine
SMILESCOC1CCCCC1Nc1cn[nH]c1
InChIInChI=1S/C10H17N3O/c1-14-10-5-3-2-4-9(10)13-8-6-11-12-7-8/h6-7,9-10,13H,2-5H2,1H3,(H,11,12)
InChIKeyYDPQUCYIZCGLQK-UHFFFAOYSA-N
XLogP1.78
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine?
The IUPAC name of N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine (CID 43776920) is N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine.
What is the SMILES notation for N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine?
The canonical SMILES for N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine is COC1CCCCC1Nc1cn[nH]c1.
What is the InChIKey of N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine?
The InChIKey is YDPQUCYIZCGLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-14-10-5-3-2-4-9(10)13-8-6-11-12-7-8/h6-7,9-10,13H,2-5H2,1H3,(H,11,12).
What are the key properties of N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine?
N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine has a molecular weight of 195.27 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxycyclohexyl)-1H-pyrazol-4-amine is sourced from PubChem (CID 43776920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).