1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine

C12H22N4O — CID 79092954

IUPAC1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
SMILESCCn1nccc1C(NC)C1CN(C)CCO1
InChIInChI=1S/C12H22N4O/c1-4-16-10(5-6-14-16)12(13-2)11-9-15(3)7-8-17-11/h5-6,11-13H,4,7-9H2,1-3H3
InChIKeySFEMFTCNAOPEPO-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.49
Rot. Bonds4

About 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine

1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine (PubChem CID 79092954) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
PubChem CID79092954
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
SMILESCCn1nccc1C(NC)C1CN(C)CCO1
InChIInChI=1S/C12H22N4O/c1-4-16-10(5-6-14-16)12(13-2)11-9-15(3)7-8-17-11/h5-6,11-13H,4,7-9H2,1-3H3
InChIKeySFEMFTCNAOPEPO-UHFFFAOYSA-N
XLogP0.49
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(4-ethylmorpholin-2-yl)-(2-ethylpyrazol-3-yl)methyl]hydrazine
CID 105247627
N-[(4-chloro-1-ethylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 114657208
[(4-methylmorpholin-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105244278
1-cyclopentyl-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 63976376
1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65423027
3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine
CID 79092957
1-(7-bicyclo[4.1.0]heptanyl)-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 115857909
3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-2-amine
CID 79093449
1-(2,3-dihydro-1H-inden-2-yl)-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 65410721
N-[(1-ethyl-4-methoxypyrazol-5-yl)-(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 114657219
[(4-chloro-1-propylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methyl]hydrazine
CID 105244342
N-[(4-chloro-1-propylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methyl]ethanamine
CID 114657209

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine?
The IUPAC name of 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine (CID 79092954) is 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine.
What is the SMILES notation for 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine?
The canonical SMILES for 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine is CCn1nccc1C(NC)C1CN(C)CCO1.
What is the InChIKey of 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine?
The InChIKey is SFEMFTCNAOPEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-4-16-10(5-6-14-16)12(13-2)11-9-15(3)7-8-17-11/h5-6,11-13H,4,7-9H2,1-3H3.
What are the key properties of 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine?
1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine has a molecular weight of 238.33 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine is sourced from PubChem (CID 79092954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).