N-cyclopentyl-1-pentan-3-ylimidazol-2-amine

C13H23N3 — CID 106555020

IUPACN-cyclopentyl-1-pentan-3-ylimidazol-2-amine
SMILESCCC(CC)n1ccnc1NC1CCCC1
InChIInChI=1S/C13H23N3/c1-3-12(4-2)16-10-9-14-13(16)15-11-7-5-6-8-11/h9-12H,3-8H2,1-2H3,(H,14,15)
InChIKeyTVXVEJKVTOJLIJ-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.60
Rot. Bonds5

About N-cyclopentyl-1-pentan-3-ylimidazol-2-amine

N-cyclopentyl-1-pentan-3-ylimidazol-2-amine (PubChem CID 106555020) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-cyclopentyl-1-pentan-3-ylimidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-pentan-3-ylimidazol-2-amine
PubChem CID106555020
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-cyclopentyl-1-pentan-3-ylimidazol-2-amine
SMILESCCC(CC)n1ccnc1NC1CCCC1
InChIInChI=1S/C13H23N3/c1-3-12(4-2)16-10-9-14-13(16)15-11-7-5-6-8-11/h9-12H,3-8H2,1-2H3,(H,14,15)
InChIKeyTVXVEJKVTOJLIJ-UHFFFAOYSA-N
XLogP3.60
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 ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-pentan-3-ylimidazol-2-amine
CID 106555013
N-cyclohexyl-1-(4-methylsulfinylbutan-2-yl)imidazol-2-amine
CID 106582432
N-(1-propan-2-ylimidazol-2-yl)piperidin-4-amine
CID 115026071
N-cyclohexyl-1-methylimidazol-2-amine
CID 57183550
1-[1-(4-chlorophenyl)ethyl]-N-cyclohexylimidazol-2-amine
CID 106565810
1-[1-(4-bromophenyl)ethyl]-N-cyclohexylimidazol-2-amine
CID 106566865
N-cyclopropyl-1-(2-methylbutyl)imidazol-2-amine
CID 106570372
N-cyclopropyl-1-(2-ethylcyclohexyl)imidazol-2-amine
CID 106568167
N-cyclopentyl-1-cyclopropylimidazol-2-amine
CID 106554935
N-cyclohexyl-1-(2,2-dimethylpropyl)imidazol-2-amine
CID 106563673
3-(cycloheptylamino)-1-propan-2-ylpyrazin-2-one
CID 62939319
N-cyclopentyl-1-(2-methyl-3-methylsulfanylpropyl)imidazol-2-amine
CID 106572670

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-pentan-3-ylimidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-pentan-3-ylimidazol-2-amine (CID 106555020) is N-cyclopentyl-1-pentan-3-ylimidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-pentan-3-ylimidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-pentan-3-ylimidazol-2-amine is CCC(CC)n1ccnc1NC1CCCC1.
What is the InChIKey of N-cyclopentyl-1-pentan-3-ylimidazol-2-amine?
The InChIKey is TVXVEJKVTOJLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-3-12(4-2)16-10-9-14-13(16)15-11-7-5-6-8-11/h9-12H,3-8H2,1-2H3,(H,14,15).
What are the key properties of N-cyclopentyl-1-pentan-3-ylimidazol-2-amine?
N-cyclopentyl-1-pentan-3-ylimidazol-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-pentan-3-ylimidazol-2-amine is sourced from PubChem (CID 106555020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).