[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine

C12H22N4O — CID 114556434

IUPAC[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine
SMILESCCCn1nccc1CN1CCOC(CN)C1
InChIInChI=1S/C12H22N4O/c1-2-5-16-11(3-4-14-16)9-15-6-7-17-12(8-13)10-15/h3-4,12H,2,5-10,13H2,1H3
InChIKeyUEYSFXBEHUSNFM-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.45
Rot. Bonds5

About [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine

[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine (PubChem CID 114556434) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine
PubChem CID114556434
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine
SMILESCCCn1nccc1CN1CCOC(CN)C1
InChIInChI=1S/C12H22N4O/c1-2-5-16-11(3-4-14-16)9-15-6-7-17-12(8-13)10-15/h3-4,12H,2,5-10,13H2,1H3
InChIKeyUEYSFXBEHUSNFM-UHFFFAOYSA-N
XLogP0.45
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine
CID 120844523
2-[1-[(2-propylpyrazol-3-yl)methyl]piperidin-4-yl]ethanamine
CID 114556350
[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 10308229
[(2R)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 11346392
[4-[(4-methyl-3-pyridinyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 120844442
[4-[(1,3-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]methanamine
CID 114393371
(4-dodecylmorpholin-2-yl)methanamine
CID 63486829
[4-[(4-propan-2-ylphenyl)methyl]morpholin-2-yl]methanamine
CID 61338959
[4-[(2-chloro-4-pyridinyl)methyl]morpholin-2-yl]methanamine
CID 114394884
4-[(2-ethylpyrazol-3-yl)methyl]-N-methylmorpholine-2-carboxamide
CID 86786686
[4-[(2,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 114393379
[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine
CID 114397886

Frequently Asked Questions

What is the IUPAC name of [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine (CID 114556434) is [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine is CCCn1nccc1CN1CCOC(CN)C1.
What is the InChIKey of [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine?
The InChIKey is UEYSFXBEHUSNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-2-5-16-11(3-4-14-16)9-15-6-7-17-12(8-13)10-15/h3-4,12H,2,5-10,13H2,1H3.
What are the key properties of [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine?
[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine has a molecular weight of 238.33 g/mol, XLogP of 0.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 114556434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).