N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine

C13H24N4O — CID 115761765

IUPACN-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
SMILESCCn1nccc1CNC(C)CN1CCOCC1
InChIInChI=1S/C13H24N4O/c1-3-17-13(4-5-15-17)10-14-12(2)11-16-6-8-18-9-7-16/h4-5,12,14H,3,6-11H2,1-2H3
InChIKeyJJOLKRQNIAUINP-UHFFFAOYSA-N
MW252.36 g/mol
LogP0.71
Rot. Bonds6

About N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine

N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine (PubChem CID 115761765) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
PubChem CID115761765
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC NameN-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
SMILESCCn1nccc1CNC(C)CN1CCOCC1
InChIInChI=1S/C13H24N4O/c1-3-17-13(4-5-15-17)10-14-12(2)11-16-6-8-18-9-7-16/h4-5,12,14H,3,6-11H2,1-2H3
InChIKeyJJOLKRQNIAUINP-UHFFFAOYSA-N
XLogP0.71
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
CID 62699740
N-[(2-ethylpyrazol-3-yl)methyl]hexan-2-amine
CID 114555701
(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine
CID 97358257
N-[(5-ethylfuran-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 62345255
1-morpholin-4-yl-N-[(3-propylimidazol-4-yl)methyl]propan-2-amine
CID 66129529
1-morpholin-4-yl-N-[(1-propan-2-ylpyrazol-3-yl)methyl]propan-2-amine
CID 64771808
N-[(1-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 78921223
N-[(1-butan-2-ylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 64801639
(1R)-1-cyclopentyl-N-[(2-ethylpyrazol-3-yl)methyl]ethanamine
CID 104939445
N-[(2,4-dichlorophenyl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 43675759
1-(2,6-difluorophenyl)-N-[(2-ethylpyrazol-3-yl)methyl]propan-2-amine
CID 115761813
1-morpholin-4-yl-N-[(1-propylimidazol-2-yl)methyl]propan-2-amine
CID 62956125

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine (CID 115761765) is N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine.
What is the SMILES notation for N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The canonical SMILES for N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine is CCn1nccc1CNC(C)CN1CCOCC1.
What is the InChIKey of N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The InChIKey is JJOLKRQNIAUINP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-3-17-13(4-5-15-17)10-14-12(2)11-16-6-8-18-9-7-16/h4-5,12,14H,3,6-11H2,1-2H3.
What are the key properties of N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine has a molecular weight of 252.36 g/mol, XLogP of 0.71, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine is sourced from PubChem (CID 115761765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).