1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine

C14H26N4O — CID 83099735

IUPAC1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine
SMILESCCc1cc(CN2CCOCC2CNC)n(CC)n1
InChIInChI=1S/C14H26N4O/c1-4-12-8-13(18(5-2)16-12)10-17-6-7-19-11-14(17)9-15-3/h8,14-15H,4-7,9-11H2,1-3H3
InChIKeyQMDDTQYQWGHEFR-UHFFFAOYSA-N
MW266.39 g/mol
LogP0.89
Rot. Bonds6

About 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine

1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine (PubChem CID 83099735) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine
PubChem CID83099735
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine
SMILESCCc1cc(CN2CCOCC2CNC)n(CC)n1
InChIInChI=1S/C14H26N4O/c1-4-12-8-13(18(5-2)16-12)10-17-6-7-19-11-14(17)9-15-3/h8,14-15H,4-7,9-11H2,1-3H3
InChIKeyQMDDTQYQWGHEFR-UHFFFAOYSA-N
XLogP0.89
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[(3,5-dimethylphenyl)methyl]morpholin-3-yl]-N-methylmethanamine
CID 83100798
N-methyl-1-[4-[(2-propyl-1,2,4-triazol-3-yl)methyl]morpholin-3-yl]methanamine
CID 83099732
1-[2-[(1,3-diethylpyrazol-5-yl)methyl]cyclobutyl]-N-methylmethanamine
CID 81016860
3-[[3-(methylaminomethyl)morpholin-4-yl]methyl]phenol
CID 83099978
1-[4-(2,3-dihydro-1H-inden-5-ylmethyl)morpholin-3-yl]-N-methylmethanamine
CID 83100150
1-[4-[(4-chloro-1,3-dimethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine
CID 83099899
N,N-diethyl-2-[3-(methylaminomethyl)morpholin-4-yl]ethanamine
CID 107912675
N-methyl-1-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]methanamine
CID 83099643
N-[[4-[(2,5-dimethylpyrazol-3-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100020
(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine
CID 82755426
1-[(1,3-diethylpyrazol-5-yl)methyl]-3,5-diethylpyrazole
CID 82699372
N-methyl-1-(4-octylmorpholin-3-yl)methanamine
CID 83099737

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine (CID 83099735) is 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine is CCc1cc(CN2CCOCC2CNC)n(CC)n1.
What is the InChIKey of 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine?
The InChIKey is QMDDTQYQWGHEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-4-12-8-13(18(5-2)16-12)10-17-6-7-19-11-14(17)9-15-3/h8,14-15H,4-7,9-11H2,1-3H3.
What are the key properties of 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine?
1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine has a molecular weight of 266.39 g/mol, XLogP of 0.89, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(1,3-diethylpyrazol-5-yl)methyl]morpholin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 83099735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).