3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine

C14H18N4O — CID 82171782

IUPAC3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
SMILESNc1cc(CN2CCOCC2)nn1-c1ccccc1
InChIInChI=1S/C14H18N4O/c15-14-10-12(11-17-6-8-19-9-7-17)16-18(14)13-4-2-1-3-5-13/h1-5,10H,6-9,11,15H2
InChIKeySRBBOUODFAYVGU-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.29
Rot. Bonds3

About 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine

3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine (PubChem CID 82171782) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine.

Molecular Properties

Compound Name3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
PubChem CID82171782
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
SMILESNc1cc(CN2CCOCC2)nn1-c1ccccc1
InChIInChI=1S/C14H18N4O/c15-14-10-12(11-17-6-8-19-9-7-17)16-18(14)13-4-2-1-3-5-13/h1-5,10H,6-9,11,15H2
InChIKeySRBBOUODFAYVGU-UHFFFAOYSA-N
XLogP1.29
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-(2-morpholin-4-ylethoxy)phenyl]-3-phenylpyrazol-5-amine
CID 161408608
4-[5-amino-3-(morpholin-4-ylmethyl)-4-phenylpyrazol-1-yl]benzoic acid
CID 2336523
5-methyl-2-(3-morpholin-4-ylphenyl)pyrazol-3-amine
CID 126743353
3-[5-amino-3-(aminomethyl)pyrazol-1-yl]phenol
CID 83864512
3-(morpholin-4-ylmethyl)naphthalen-2-amine
CID 61214111
4-[[(3S)-3-phenyl-2,3-dihydro-1,2,4-oxadiazol-5-yl]methyl]morpholine
CID 125474926
3,5-dimethyl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1-phenylpyrazole-4-carboxamide
CID 31787078
4-chloro-6-(morpholin-4-ylmethyl)pyrimidin-2-amine
CID 105486071
3,4-dimethyl-7-(2-morpholin-4-ylethyl)-1-phenylpyrazolo[5,4-b]pyridin-6-one
CID 9147164
5-(morpholin-4-ylmethyl)-2-phenyl-4H-pyrazol-3-one
CID 86175824
7-(morpholin-4-ylmethyl)-5-phenylpyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 141191635
3-[[16-[(3-aminophenyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]aniline
CID 15495103

Frequently Asked Questions

What is the IUPAC name of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
The IUPAC name of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine (CID 82171782) is 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine.
What is the SMILES notation for 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
The canonical SMILES for 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine is Nc1cc(CN2CCOCC2)nn1-c1ccccc1.
What is the InChIKey of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
The InChIKey is SRBBOUODFAYVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-14-10-12(11-17-6-8-19-9-7-17)16-18(14)13-4-2-1-3-5-13/h1-5,10H,6-9,11,15H2.
What are the key properties of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine has a molecular weight of 258.32 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine is sourced from PubChem (CID 82171782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).