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

C15H25N3 — CID 103019932

IUPACN-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine
SMILESCn1cc(CCC2CCCC2CNC2CC2)cn1
InChIInChI=1S/C15H25N3/c1-18-11-12(9-17-18)5-6-13-3-2-4-14(13)10-16-15-7-8-15/h9,11,13-16H,2-8,10H2,1H3
InChIKeyLNKKODLTCVAYNA-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.52
Rot. Bonds6

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

N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine (PubChem CID 103019932) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine
PubChem CID103019932
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine
SMILESCn1cc(CCC2CCCC2CNC2CC2)cn1
InChIInChI=1S/C15H25N3/c1-18-11-12(9-17-18)5-6-13-3-2-4-14(13)10-16-15-7-8-15/h9,11,13-16H,2-8,10H2,1H3
InChIKeyLNKKODLTCVAYNA-UHFFFAOYSA-N
XLogP2.52
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cycloheptyl]methyl]cyclopropanamine
CID 103020041
N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclohexyl]methyl]ethanamine
CID 103019952
N-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentanamine
CID 112730166
3-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]cyclopentan-1-amine
CID 115653177
2-(chloromethyl)-N-[2-(1-methylpyrazol-4-yl)ethyl]cyclohexan-1-amine
CID 106365346
2-[2-(1-methylpyrazol-4-yl)ethyl]cyclobutane-1-carboxylic acid
CID 103019561
N-[2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
CID 103014322
4-[2-(1-methylpyrazol-4-yl)ethyl]thiolan-3-amine
CID 103004599
2-(cyclopropylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]ethanesulfonamide
CID 106073619
N-[4-methyl-2-[2-(1-methylpyrazol-4-yl)ethyl]pentyl]cyclopropanamine
CID 103014311
N-[4-methyl-6-(1-methylpyrazol-4-yl)hex-3-enyl]cyclopropanamine
CID 103019344
2-[(1-methylpyrazol-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 62127989

Frequently Asked Questions

What is the IUPAC name of N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine (CID 103019932) is N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine is Cn1cc(CCC2CCCC2CNC2CC2)cn1.
What is the InChIKey of N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine?
The InChIKey is LNKKODLTCVAYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-18-11-12(9-17-18)5-6-13-3-2-4-14(13)10-16-15-7-8-15/h9,11,13-16H,2-8,10H2,1H3.
What are the key properties of N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine?
N-[[2-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentyl]methyl]cyclopropanamine has a molecular weight of 247.39 g/mol, XLogP of 2.52, 6 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]cyclopentyl]methyl]cyclopropanamine is sourced from PubChem (CID 103019932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).