2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine

C15H26N4O — CID 82877836

IUPAC2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
SMILESCn1ccc(CC(N)C2(N3CCOCC3)CCCC2)n1
InChIInChI=1S/C15H26N4O/c1-18-7-4-13(17-18)12-14(16)15(5-2-3-6-15)19-8-10-20-11-9-19/h4,7,14H,2-3,5-6,8-12,16H2,1H3
InChIKeyMQCUMYNKIVACGT-UHFFFAOYSA-N
MW278.40 g/mol
LogP0.93
Rot. Bonds4

About 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine

2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine (PubChem CID 82877836) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
PubChem CID82877836
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
SMILESCn1ccc(CC(N)C2(N3CCOCC3)CCCC2)n1
InChIInChI=1S/C15H26N4O/c1-18-7-4-13(17-18)12-14(16)15(5-2-3-6-15)19-8-10-20-11-9-19/h4,7,14H,2-3,5-6,8-12,16H2,1H3
InChIKeyMQCUMYNKIVACGT-UHFFFAOYSA-N
XLogP0.93
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
The IUPAC name of 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine (CID 82877836) is 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine.
What is the SMILES notation for 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
The canonical SMILES for 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine is Cn1ccc(CC(N)C2(N3CCOCC3)CCCC2)n1.
What is the InChIKey of 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
The InChIKey is MQCUMYNKIVACGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-18-7-4-13(17-18)12-14(16)15(5-2-3-6-15)19-8-10-20-11-9-19/h4,7,14H,2-3,5-6,8-12,16H2,1H3.
What are the key properties of 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine?
2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine has a molecular weight of 278.40 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine is sourced from PubChem (CID 82877836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).