1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine

C14H25N3 — CID 64785449

IUPAC1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine
SMILESCCC(CC)n1ccc(CC2(N)CCCC2)n1
InChIInChI=1S/C14H25N3/c1-3-13(4-2)17-10-7-12(16-17)11-14(15)8-5-6-9-14/h7,10,13H,3-6,8-9,11,15H2,1-2H3
InChIKeyMIZBKNRCYDPCPE-UHFFFAOYSA-N
MW235.38 g/mol
LogP3.06
Rot. Bonds5

About 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine

1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine (PubChem CID 64785449) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine
PubChem CID64785449
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine
SMILESCCC(CC)n1ccc(CC2(N)CCCC2)n1
InChIInChI=1S/C14H25N3/c1-3-13(4-2)17-10-7-12(16-17)11-14(15)8-5-6-9-14/h7,10,13H,3-6,8-9,11,15H2,1-2H3
InChIKeyMIZBKNRCYDPCPE-UHFFFAOYSA-N
XLogP3.06
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-dimethyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclohexan-1-ol
CID 64784476
3-[(3-methylazetidin-3-yl)methyl]-1-pentan-3-ylpyrazole
CID 79451419
2-cyclopropyl-3-[(1-pentan-3-ylpyrazol-3-yl)methyl]oxolan-3-amine
CID 104510350
2-methoxy-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclohexan-1-ol
CID 106873747
4-[(1-pentan-3-ylpyrazol-3-yl)methyl]oxepan-4-ol
CID 65079479
[3-[(1-pentan-3-ylpyrazol-3-yl)methyl]pyrrolidin-3-yl]methanol
CID 66059014
3-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-one
CID 116538402
2-[(1-pentan-3-ylpyrazol-3-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 65020117
N-methyl-1-(1-methylcyclopentyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanamine
CID 104991851
3-(bromomethyl)-1-pentan-3-ylpyrazole
CID 81222884
1-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 64785884
[1-[(1-butan-2-ylpyrazol-3-yl)methyl]cyclohexyl]methanamine
CID 64778489

Frequently Asked Questions

What is the IUPAC name of 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine (CID 64785449) is 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine is CCC(CC)n1ccc(CC2(N)CCCC2)n1.
What is the InChIKey of 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine?
The InChIKey is MIZBKNRCYDPCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-13(4-2)17-10-7-12(16-17)11-14(15)8-5-6-9-14/h7,10,13H,3-6,8-9,11,15H2,1-2H3.
What are the key properties of 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine?
1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine has a molecular weight of 235.38 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 64785449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).