N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine

C14H23N3 — CID 66441337

IUPACN-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine
SMILESCCc1c(CNC2CC2)cnn1C1CCCC1
InChIInChI=1S/C14H23N3/c1-2-14-11(9-15-12-7-8-12)10-16-17(14)13-5-3-4-6-13/h10,12-13,15H,2-9H2,1H3
InChIKeyAMYAGSDTESXJAT-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.81
Rot. Bonds5

About N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine

N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine (PubChem CID 66441337) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine
PubChem CID66441337
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine
SMILESCCc1c(CNC2CC2)cnn1C1CCCC1
InChIInChI=1S/C14H23N3/c1-2-14-11(9-15-12-7-8-12)10-16-17(14)13-5-3-4-6-13/h10,12-13,15H,2-9H2,1H3
InChIKeyAMYAGSDTESXJAT-UHFFFAOYSA-N
XLogP2.81
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine (CID 66441337) is N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine is CCc1c(CNC2CC2)cnn1C1CCCC1.
What is the InChIKey of N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine?
The InChIKey is AMYAGSDTESXJAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-14-11(9-15-12-7-8-12)10-16-17(14)13-5-3-4-6-13/h10,12-13,15H,2-9H2,1H3.
What are the key properties of N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine?
N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine has a molecular weight of 233.36 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyl-5-ethylpyrazol-4-yl)methyl]cyclopropanamine is sourced from PubChem (CID 66441337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).