N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine

C14H25N3 — CID 103014322

IUPACN-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
SMILESCCCC(CCc1cnn(C)c1)CNC1CC1
InChIInChI=1S/C14H25N3/c1-3-4-12(9-15-14-7-8-14)5-6-13-10-16-17(2)11-13/h10-12,14-15H,3-9H2,1-2H3
InChIKeySWHHMLWFPMADCN-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.52
Rot. Bonds8

About N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine

N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine (PubChem CID 103014322) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
PubChem CID103014322
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
SMILESCCCC(CCc1cnn(C)c1)CNC1CC1
InChIInChI=1S/C14H25N3/c1-3-4-12(9-15-14-7-8-14)5-6-13-10-16-17(2)11-13/h10-12,14-15H,3-9H2,1-2H3
InChIKeySWHHMLWFPMADCN-UHFFFAOYSA-N
XLogP2.52
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-methyl-2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
CID 103014311
2-cyclopentyl-4-(1-methylpyrazol-4-yl)-N-propylbutan-1-amine
CID 103014821
N-[2-(1-methylpyrazol-4-yl)oxypentyl]cyclopropanamine
CID 116793651
N-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentanamine
CID 112730166
N-[2-methyl-2-[(1-methylpyrazol-4-yl)methyl]pentyl]cyclopropanamine
CID 62724831
2-[(1-methylpyrazol-4-yl)methyl]pentan-1-amine
CID 62505722
1-cyclopropyl-N-methyl-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 63354994
2,2-dicyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]ethanamine
CID 103001567
1-methyl-4-propylpyrazole;propane
CID 155742221
2-benzyl-4-(1-methylpyrazol-4-yl)-N-propylbutan-1-amine
CID 103014292
4-(3-bromo-3-cyclopropylpropyl)-1-methylpyrazole
CID 63358314
1-cyclopropyl-N-[(1-methylpyrazol-4-yl)methyl]butan-1-amine
CID 115769846

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine?
The IUPAC name of N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine (CID 103014322) is N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine.
What is the SMILES notation for N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine?
The canonical SMILES for N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine is CCCC(CCc1cnn(C)c1)CNC1CC1.
What is the InChIKey of N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine?
The InChIKey is SWHHMLWFPMADCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-4-12(9-15-14-7-8-14)5-6-13-10-16-17(2)11-13/h10-12,14-15H,3-9H2,1-2H3.
What are the key properties of N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine?
N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine has a molecular weight of 235.37 g/mol, XLogP of 2.52, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine is sourced from PubChem (CID 103014322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).