N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine

C14H25N3 — CID 65410246

IUPACN-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
SMILESCCNC(c1cnn(C)c1)C1CCC(CC)C1
InChIInChI=1S/C14H25N3/c1-4-11-6-7-12(8-11)14(15-5-2)13-9-16-17(3)10-13/h9-12,14-15H,4-8H2,1-3H3
InChIKeyZYNGDPWYJQTTMS-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.90
Rot. Bonds5

About N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine

N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine (PubChem CID 65410246) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
PubChem CID65410246
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
SMILESCCNC(c1cnn(C)c1)C1CCC(CC)C1
InChIInChI=1S/C14H25N3/c1-4-11-6-7-12(8-11)14(15-5-2)13-9-16-17(3)10-13/h9-12,14-15H,4-8H2,1-3H3
InChIKeyZYNGDPWYJQTTMS-UHFFFAOYSA-N
XLogP2.90
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-ethylcyclohexyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 65195064
N-[(3,4-dimethylcyclohexyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 65195505
N-[(3,5-dimethylcyclohexyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 65195899
N-[(2-ethylcyclohexyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 65195450
N-[(1-methylpyrazol-4-yl)-(oxan-3-yl)methyl]ethanamine
CID 65332421
N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine
CID 65411617
N-[(3,4-dimethylphenyl)-(3-ethylcyclopentyl)methyl]ethanamine
CID 65411811
1-cyclopropyl-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 43485930
N-ethyl-1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 65413948
N-[(3,5-dimethylcyclohexyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine
CID 65200078
[1-(3-ethylcyclopentyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105233556
N-ethyl-1-(1-methylpyrazol-4-yl)ethanamine
CID 43492401

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine?
The IUPAC name of N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine (CID 65410246) is N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine.
What is the SMILES notation for N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine?
The canonical SMILES for N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine is CCNC(c1cnn(C)c1)C1CCC(CC)C1.
What is the InChIKey of N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine?
The InChIKey is ZYNGDPWYJQTTMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-11-6-7-12(8-11)14(15-5-2)13-9-16-17(3)10-13/h9-12,14-15H,4-8H2,1-3H3.
What are the key properties of N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine?
N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine has a molecular weight of 235.37 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine is sourced from PubChem (CID 65410246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).