(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine

C14H25N3O — CID 114655202

IUPAC(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
SMILESCCC1CCC(C(N)c2c(OC)cnn2C)CC1
InChIInChI=1S/C14H25N3O/c1-4-10-5-7-11(8-6-10)13(15)14-12(18-3)9-16-17(14)2/h9-11,13H,4-8,15H2,1-3H3
InChIKeyIMAXCCKWOXPPDP-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.64
Rot. Bonds4

About (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine

(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine (PubChem CID 114655202) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine.

Molecular Properties

Compound Name(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
PubChem CID114655202
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
SMILESCCC1CCC(C(N)c2c(OC)cnn2C)CC1
InChIInChI=1S/C14H25N3O/c1-4-10-5-7-11(8-6-10)13(15)14-12(18-3)9-16-17(14)2/h9-11,13H,4-8,15H2,1-3H3
InChIKeyIMAXCCKWOXPPDP-UHFFFAOYSA-N
XLogP2.64
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114646874
(3-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114644051
(4-ethylcyclohexyl)-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methanol
CID 114643994
(4-ethylcyclohexyl)-(3-methoxy-4-pyridinyl)methanamine
CID 105065687
N-[(4-ethylcyclohexyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]ethanamine
CID 114655232
1-(4-methoxy-1-methylpyrazol-5-yl)-2-methylbutan-1-amine
CID 114651682
(4,4-difluorocyclohexyl)-(4-methoxy-1-propylpyrazol-5-yl)methanamine
CID 105187165
[(3-ethylcyclopentyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105233464
2-cyclohexyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114662095
1-(4-methoxy-1-methylpyrazol-5-yl)-2,2-dimethylbutan-1-amine
CID 105047205
2-(1,1-dioxothiolan-3-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 105186241
1-(4-methoxy-1-methylpyrazol-5-yl)hexan-1-amine
CID 105047246

Frequently Asked Questions

What is the IUPAC name of (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
The IUPAC name of (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine (CID 114655202) is (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine.
What is the SMILES notation for (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
The canonical SMILES for (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine is CCC1CCC(C(N)c2c(OC)cnn2C)CC1.
What is the InChIKey of (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
The InChIKey is IMAXCCKWOXPPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-4-10-5-7-11(8-6-10)13(15)14-12(18-3)9-16-17(14)2/h9-11,13H,4-8,15H2,1-3H3.
What are the key properties of (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine has a molecular weight of 251.37 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine is sourced from PubChem (CID 114655202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).