(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine

C15H28N4O2 — CID 114657848

IUPAC(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCOc1cnn(C(C)C)c1C(N)C1CN(C(C)C)CCO1
InChIInChI=1S/C15H28N4O2/c1-10(2)18-6-7-21-13(9-18)14(16)15-12(20-5)8-17-19(15)11(3)4/h8,10-11,13-14H,6-7,9,16H2,1-5H3
InChIKeyGTJYWFOKVUVXST-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.58
Rot. Bonds5

About (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine

(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine (PubChem CID 114657848) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
PubChem CID114657848
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC Name(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCOc1cnn(C(C)C)c1C(N)C1CN(C(C)C)CCO1
InChIInChI=1S/C15H28N4O2/c1-10(2)18-6-7-21-13(9-18)14(16)15-12(20-5)8-17-19(15)11(3)4/h8,10-11,13-14H,6-7,9,16H2,1-5H3
InChIKeyGTJYWFOKVUVXST-UHFFFAOYSA-N
XLogP1.58
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methanamine
CID 114657180
[(4-methoxy-1-methylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248155
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248212
(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 104515903
(1-ethyl-4-methoxypyrazol-5-yl)-(4-propylmorpholin-2-yl)methanamine
CID 114657813
(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 114688564
2-[5-[amino-(4-methylmorpholin-2-yl)methyl]-4-methoxypyrazol-1-yl]-N,N-dimethylethanamine
CID 114657181
phenyl-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665183
2-bicyclo[2.2.1]heptanyl-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methanamine
CID 114660326
1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2-(oxolan-2-yl)ethanamine
CID 114646684
(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(1-methylcyclopropyl)methanamine
CID 114658533
(1,1-dioxothiolan-3-yl)-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methanamine
CID 114659408

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The IUPAC name of (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine (CID 114657848) is (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The canonical SMILES for (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine is COc1cnn(C(C)C)c1C(N)C1CN(C(C)C)CCO1.
What is the InChIKey of (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The InChIKey is GTJYWFOKVUVXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-10(2)18-6-7-21-13(9-18)14(16)15-12(20-5)8-17-19(15)11(3)4/h8,10-11,13-14H,6-7,9,16H2,1-5H3.
What are the key properties of (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine has a molecular weight of 296.42 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 114657848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).