4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine

C12H22N4O — CID 64535535

IUPAC4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine
SMILESCc1cn(CC2CN(C(C)C)CCO2)nc1N
InChIInChI=1S/C12H22N4O/c1-9(2)15-4-5-17-11(7-15)8-16-6-10(3)12(13)14-16/h6,9,11H,4-5,7-8H2,1-3H3,(H2,13,14)
InChIKeyVSNDHOUIQOBZDE-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.88
Rot. Bonds3

About 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine

4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine (PubChem CID 64535535) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine
PubChem CID64535535
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine
SMILESCc1cn(CC2CN(C(C)C)CCO2)nc1N
InChIInChI=1S/C12H22N4O/c1-9(2)15-4-5-17-11(7-15)8-16-6-10(3)12(13)14-16/h6,9,11H,4-5,7-8H2,1-3H3,(H2,13,14)
InChIKeyVSNDHOUIQOBZDE-UHFFFAOYSA-N
XLogP0.88
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5-methylpyrazol-1-yl)methyl]-4-propan-2-ylmorpholine
CID 64534558
N-[[1-[(4-propan-2-ylmorpholin-2-yl)methyl]triazol-4-yl]methyl]ethanamine
CID 66192747
5-amino-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrimidine-2,4-dione
CID 64535130
1-[(4-propan-2-ylmorpholin-2-yl)methyl]imidazole-4-sulfonyl chloride
CID 82913357
4-propan-2-yl-5-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]-1,2,4-triazol-3-amine
CID 64534933
ethane;2-(methoxymethyl)-4-propan-2-ylmorpholine
CID 164585009
(4-propan-2-ylmorpholin-2-yl)methyl 2-(4-aminopyrazol-1-yl)acetate
CID 64533747
5,6-dichloro-3-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrimidin-4-one
CID 114583244
6-chloro-5-methoxy-3-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrimidin-4-one
CID 114585446
(2S)-2-[[4-[(3-ethyl-1-methylpyrazol-4-yl)methyl]piperazin-1-yl]methyl]-4-propan-2-ylmorpholine
CID 124614801
3-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrole-2-carboxylic acid
CID 102604816
2-methyl-6-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]aniline
CID 79146733

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine?
The IUPAC name of 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine (CID 64535535) is 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine.
What is the SMILES notation for 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine?
The canonical SMILES for 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine is Cc1cn(CC2CN(C(C)C)CCO2)nc1N.
What is the InChIKey of 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine?
The InChIKey is VSNDHOUIQOBZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-9(2)15-4-5-17-11(7-15)8-16-6-10(3)12(13)14-16/h6,9,11H,4-5,7-8H2,1-3H3,(H2,13,14).
What are the key properties of 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine?
4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine has a molecular weight of 238.33 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine is sourced from PubChem (CID 64535535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).