N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine

C14H26N4O — CID 28955379

IUPACN-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine
SMILESCCc1n[nH]c(CN(C)CCN2CCOCC2)c1C
InChIInChI=1S/C14H26N4O/c1-4-13-12(2)14(16-15-13)11-17(3)5-6-18-7-9-19-10-8-18/h4-11H2,1-3H3,(H,15,16)
InChIKeyBNIUPYVEPZIJTE-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.04
Rot. Bonds6

About N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine

N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine (PubChem CID 28955379) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine.

Molecular Properties

Compound NameN-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine
PubChem CID28955379
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine
SMILESCCc1n[nH]c(CN(C)CCN2CCOCC2)c1C
InChIInChI=1S/C14H26N4O/c1-4-13-12(2)14(16-15-13)11-17(3)5-6-18-7-9-19-10-8-18/h4-11H2,1-3H3,(H,15,16)
InChIKeyBNIUPYVEPZIJTE-UHFFFAOYSA-N
XLogP1.04
TPSA44.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine?
The IUPAC name of N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine (CID 28955379) is N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine.
What is the SMILES notation for N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine?
The canonical SMILES for N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine is CCc1n[nH]c(CN(C)CCN2CCOCC2)c1C.
What is the InChIKey of N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine?
The InChIKey is BNIUPYVEPZIJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-4-13-12(2)14(16-15-13)11-17(3)5-6-18-7-9-19-10-8-18/h4-11H2,1-3H3,(H,15,16).
What are the key properties of N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine?
N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine has a molecular weight of 266.39 g/mol, XLogP of 1.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]-N-methyl-2-morpholin-4-ylethanamine is sourced from PubChem (CID 28955379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).