N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine

C11H18FN3 — CID 126791965

IUPACN-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine
SMILESCc1cc(CNC2CCC(F)C2)n(C)n1
InChIInChI=1S/C11H18FN3/c1-8-5-11(15(2)14-8)7-13-10-4-3-9(12)6-10/h5,9-10,13H,3-4,6-7H2,1-2H3
InChIKeyQHCTVMHJMZXSED-UHFFFAOYSA-N
MW211.28 g/mol
LogP1.71
Rot. Bonds3

About N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine

N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine (PubChem CID 126791965) has the molecular formula C11H18FN3 and a molecular weight of 211.28 g/mol. Its IUPAC name is N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine.

Molecular Properties

Compound NameN-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine
PubChem CID126791965
Molecular FormulaC11H18FN3
Molecular Weight211.28 g/mol
Exact Mass211.15
IUPAC NameN-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine
SMILESCc1cc(CNC2CCC(F)C2)n(C)n1
InChIInChI=1S/C11H18FN3/c1-8-5-11(15(2)14-8)7-13-10-4-3-9(12)6-10/h5,9-10,13H,3-4,6-7H2,1-2H3
InChIKeyQHCTVMHJMZXSED-UHFFFAOYSA-N
XLogP1.71
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.28
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1,3-Dimethyl-1H-pyrazol-5-yl)methanamine
CID 1257670
2-(3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-amine
CID 1091687
3-(3,5-Dimethyl-1H-pyrazol-1-yl)propan-1-amine
CID 2056783
N-cyclopentyl-2-[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]acetamide
CID 841522
1-methyl-3-((methylamino)methyl)-1h-pyrazole-5-carbonitrile hydrochloride salt
CID 138106110
(1,5-dimethyl-1H-pyrazol-3-yl)methanamine
CID 2776367
3-(3,5-dimethyl-1H-pyrazol-1-yl)piperidine
CID 54592912
N-[2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethyl]-3,5-dimethyl-1H-pyrazole-1-ethanamine
CID 361753
1-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-amine
CID 6483889
13,26-Dimethyl-3,6,9,12,13,16,19,22,25,26-decazatricyclo[22.2.1.111,14]octacosa-1(27),11,14(28),24-tetraene;hydrochloride
CID 70693086
1-Butyl-3,5-dimethyl-1H-pyrazole
CID 573083
2-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]piperidine
CID 54592628

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine?
The IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine (CID 126791965) is N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine.
What is the SMILES notation for N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine?
The canonical SMILES for N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine is Cc1cc(CNC2CCC(F)C2)n(C)n1.
What is the InChIKey of N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine?
The InChIKey is QHCTVMHJMZXSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN3/c1-8-5-11(15(2)14-8)7-13-10-4-3-9(12)6-10/h5,9-10,13H,3-4,6-7H2,1-2H3.
What are the key properties of N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine?
N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine has a molecular weight of 211.28 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-fluorocyclopentan-1-amine is sourced from PubChem (CID 126791965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).