(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine

C14H24N4O — CID 103131092

IUPAC(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine
SMILESCn1ccc(C(N)C2(N3CCOCC3)CCCC2)n1
InChIInChI=1S/C14H24N4O/c1-17-7-4-12(16-17)13(15)14(5-2-3-6-14)18-8-10-19-11-9-18/h4,7,13H,2-3,5-6,8-11,15H2,1H3
InChIKeyOCYXUVCCTLJHEN-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.06
Rot. Bonds3

About (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine

(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine (PubChem CID 103131092) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine.

Molecular Properties

Compound Name(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine
PubChem CID103131092
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine
SMILESCn1ccc(C(N)C2(N3CCOCC3)CCCC2)n1
InChIInChI=1S/C14H24N4O/c1-17-7-4-12(16-17)13(15)14(5-2-3-6-14)18-8-10-19-11-9-18/h4,7,13H,2-3,5-6,8-11,15H2,1H3
InChIKeyOCYXUVCCTLJHEN-UHFFFAOYSA-N
XLogP1.06
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine?
The IUPAC name of (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine (CID 103131092) is (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine.
What is the SMILES notation for (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine?
The canonical SMILES for (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine is Cn1ccc(C(N)C2(N3CCOCC3)CCCC2)n1.
What is the InChIKey of (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine?
The InChIKey is OCYXUVCCTLJHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-17-7-4-12(16-17)13(15)14(5-2-3-6-14)18-8-10-19-11-9-18/h4,7,13H,2-3,5-6,8-11,15H2,1H3.
What are the key properties of (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine?
(1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine has a molecular weight of 264.37 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrazol-3-yl)-(1-morpholin-4-ylcyclopentyl)methanamine is sourced from PubChem (CID 103131092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).