N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine

C12H22N4O — CID 114253529

IUPACN-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine
SMILESCCN1CCOC(CNc2cc(C)n(C)n2)C1
InChIInChI=1S/C12H22N4O/c1-4-16-5-6-17-11(9-16)8-13-12-7-10(2)15(3)14-12/h7,11H,4-6,8-9H2,1-3H3,(H,13,14)
InChIKeyCVKMTHWYLYXWBO-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.86
Rot. Bonds4

About N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine

N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine (PubChem CID 114253529) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine
PubChem CID114253529
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine
SMILESCCN1CCOC(CNc2cc(C)n(C)n2)C1
InChIInChI=1S/C12H22N4O/c1-4-16-5-6-17-11(9-16)8-13-12-7-10(2)15(3)14-12/h7,11H,4-6,8-9H2,1-3H3,(H,13,14)
InChIKeyCVKMTHWYLYXWBO-UHFFFAOYSA-N
XLogP0.86
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-ethylmorpholin-2-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]methanamine
CID 78946770
N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
CID 114400660
N-[(4-ethylmorpholin-2-yl)methyl]-1-methylimidazol-2-amine
CID 114400676
N-[(4-ethylmorpholin-2-yl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 114400659
N-[[(2R)-4-ethylmorpholin-2-yl]methyl]quinoxalin-2-amine
CID 95319257
4-N-[(4-ethylmorpholin-2-yl)methyl]pyrimidine-2,4-diamine
CID 114401447
5-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-3-methylpyridin-2-amine
CID 115693777
N-[(4-ethylmorpholin-2-yl)methyl]-1,3-dimethyl-4-nitropyrazol-5-amine
CID 115619052
2,4,6-trichloro-N-[(4-ethylmorpholin-2-yl)methyl]aniline
CID 79164415
N-[(4-ethylmorpholin-2-yl)methyl]-5-iodopyrimidin-2-amine
CID 113459925
N-[(4-ethylmorpholin-2-yl)methyl]-3,4,5-trifluoroaniline
CID 79165761
4-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-3-methylaniline
CID 79165325

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine (CID 114253529) is N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine is CCN1CCOC(CNc2cc(C)n(C)n2)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The InChIKey is CVKMTHWYLYXWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-4-16-5-6-17-11(9-16)8-13-12-7-10(2)15(3)14-12/h7,11H,4-6,8-9H2,1-3H3,(H,13,14).
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine?
N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine has a molecular weight of 238.33 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]-1,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 114253529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).