N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine

C14H26N4O — CID 83099773

IUPACN-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
SMILESCCn1cc(CN2CCOCC2CNC(C)C)cn1
InChIInChI=1S/C14H26N4O/c1-4-18-10-13(7-16-18)9-17-5-6-19-11-14(17)8-15-12(2)3/h7,10,12,14-15H,4-6,8-9,11H2,1-3H3
InChIKeyGJACTAOIVNPXNO-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.10
Rot. Bonds6

About N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine

N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine (PubChem CID 83099773) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
PubChem CID83099773
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
SMILESCCn1cc(CN2CCOCC2CNC(C)C)cn1
InChIInChI=1S/C14H26N4O/c1-4-18-10-13(7-16-18)9-17-5-6-19-11-14(17)8-15-12(2)3/h7,10,12,14-15H,4-6,8-9,11H2,1-3H3
InChIKeyGJACTAOIVNPXNO-UHFFFAOYSA-N
XLogP1.10
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 ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine (CID 83099773) is N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine is CCn1cc(CN2CCOCC2CNC(C)C)cn1.
What is the InChIKey of N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine?
The InChIKey is GJACTAOIVNPXNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-4-18-10-13(7-16-18)9-17-5-6-19-11-14(17)8-15-12(2)3/h7,10,12,14-15H,4-6,8-9,11H2,1-3H3.
What are the key properties of N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine?
N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine has a molecular weight of 266.39 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 83099773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).