N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine

C11H19N3O — CID 116793724

IUPACN-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine
SMILESCn1cc(OCCNC2CCCC2)cn1
InChIInChI=1S/C11H19N3O/c1-14-9-11(8-13-14)15-7-6-12-10-4-2-3-5-10/h8-10,12H,2-7H2,1H3
InChIKeyNXJIACDNAUXLED-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.33
Rot. Bonds5

About N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine

N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine (PubChem CID 116793724) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine
PubChem CID116793724
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine
SMILESCn1cc(OCCNC2CCCC2)cn1
InChIInChI=1S/C11H19N3O/c1-14-9-11(8-13-14)15-7-6-12-10-4-2-3-5-10/h8-10,12H,2-7H2,1H3
InChIKeyNXJIACDNAUXLED-UHFFFAOYSA-N
XLogP1.33
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(1-propylpyrazol-4-yl)oxypropyl]cyclohexanamine
CID 116803809
N-[3-(1-ethylpyrazol-4-yl)oxypropyl]cyclohexanamine
CID 116803738
N-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentanamine
CID 112730166
2-methoxy-N-[2-(1-methylpyrazol-4-yl)oxyethyl]ethanamine
CID 116793733
N-[2-(4-propan-2-yloxypyrazol-1-yl)ethyl]cyclopentanamine
CID 114274297
3-methyl-N-[2-(1-methylpyrazol-4-yl)oxyethyl]butan-2-amine
CID 116793697
N-[[2-[2-(1-methylpyrazol-4-yl)oxyethoxy]phenyl]methyl]cyclopropanamine
CID 116793588
2-methyl-N-[2-(1-methylpyrazol-4-yl)oxyethyl]butan-2-amine
CID 116793754
N',N'-dimethyl-N-[2-(1-methylpyrazol-4-yl)oxyethyl]ethane-1,2-diamine
CID 116793723
N-[2-[(2-methyl-1,3-dihydroisoindol-5-yl)oxy]ethyl]cyclopentanamine
CID 59274109
N-[2-(3-methylphenoxy)ethyl]cyclopentanamine
CID 54798962
N-[2-(3,4-dimethylphenoxy)ethyl]cycloheptanamine
CID 63504448

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine?
The IUPAC name of N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine (CID 116793724) is N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine.
What is the SMILES notation for N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine?
The canonical SMILES for N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine is Cn1cc(OCCNC2CCCC2)cn1.
What is the InChIKey of N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine?
The InChIKey is NXJIACDNAUXLED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14-9-11(8-13-14)15-7-6-12-10-4-2-3-5-10/h8-10,12H,2-7H2,1H3.
What are the key properties of N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine?
N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine has a molecular weight of 209.29 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpyrazol-4-yl)oxyethyl]cyclopentanamine is sourced from PubChem (CID 116793724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).