2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine

C13H23N3 — CID 104629179

IUPAC2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine
SMILESCCC1CCCC1NCCc1ccn(C)n1
InChIInChI=1S/C13H23N3/c1-3-11-5-4-6-13(11)14-9-7-12-8-10-16(2)15-12/h8,10-11,13-14H,3-7,9H2,1-2H3
InChIKeyCXPSGKXSKYJXNX-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.13
Rot. Bonds5

About 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine

2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine (PubChem CID 104629179) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine
PubChem CID104629179
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine
SMILESCCC1CCCC1NCCc1ccn(C)n1
InChIInChI=1S/C13H23N3/c1-3-11-5-4-6-13(11)14-9-7-12-8-10-16(2)15-12/h8,10-11,13-14H,3-7,9H2,1-2H3
InChIKeyCXPSGKXSKYJXNX-UHFFFAOYSA-N
XLogP2.13
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylcyclohexan-1-amine
CID 113434855
N-[2-(1-methylpyrazol-3-yl)ethyl]-2-piperidin-2-ylcyclohexan-1-amine
CID 106104216
2-ethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]cyclohexan-1-amine
CID 113442329
5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylcyclohexan-1-amine
CID 104629202
N-[2-(1-methylpyrazol-3-yl)ethyl]-3,4-dihydro-2H-thiochromen-4-amine
CID 104629142
2-[(1-methylpyrazol-3-yl)methylamino]cyclohexan-1-ol
CID 78967242
6-bromo-N-[2-(1-methylpyrazol-3-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 104629094
2-ethyl-N-(2-quinolin-8-ylethyl)cyclopentan-1-amine
CID 115708839
3-[2-(1-methylpyrazol-3-yl)ethylamino]pyrrolidine-2,5-dione
CID 106104437
3-[2-(1-methylpyrazol-3-yl)ethylcarbamoylamino]cyclohexane-1-carboxylic acid
CID 106105963
3-[(1-methylpyrazol-3-yl)methyl]-N-propylcyclohexan-1-amine
CID 82870644
N-[2-(1-methylpyrazol-3-yl)ethyl]ethanesulfonamide
CID 104626606

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine (CID 104629179) is 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine is CCC1CCCC1NCCc1ccn(C)n1.
What is the InChIKey of 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine?
The InChIKey is CXPSGKXSKYJXNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-3-11-5-4-6-13(11)14-9-7-12-8-10-16(2)15-12/h8,10-11,13-14H,3-7,9H2,1-2H3.
What are the key properties of 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine?
2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine has a molecular weight of 221.35 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 104629179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).