1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine

C14H27N3 — CID 80560358

IUPAC1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine
SMILESCCCCCC1(C)CN=C(N)N1C1CCCC1
InChIInChI=1S/C14H27N3/c1-3-4-7-10-14(2)11-16-13(15)17(14)12-8-5-6-9-12/h12H,3-11H2,1-2H3,(H2,15,16)
InChIKeyWMORVMAPGIVAAG-UHFFFAOYSA-N
MW237.39 g/mol
LogP2.90
Rot. Bonds5

About 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine

1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine (PubChem CID 80560358) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine
PubChem CID80560358
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine
SMILESCCCCCC1(C)CN=C(N)N1C1CCCC1
InChIInChI=1S/C14H27N3/c1-3-4-7-10-14(2)11-16-13(15)17(14)12-8-5-6-9-12/h12H,3-11H2,1-2H3,(H2,15,16)
InChIKeyWMORVMAPGIVAAG-UHFFFAOYSA-N
XLogP2.90
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine
CID 79498255
1-cyclopentyl-8-propyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79521648
1-cyclopropyl-5,5-diethyl-4H-imidazol-2-amine
CID 79509325
1-cycloheptyl-8-propyl-1,3,8-triazaspiro[4.5]dec-2-en-2-amine
CID 79496898
1-cyclopentyl-5-ethyl-5-(2-methylbutyl)-4H-imidazol-2-amine
CID 79521031
1-cyclopentyl-8-ethyl-1,3-diazaspiro[4.4]non-2-en-2-amine
CID 79520870
1-cyclopentyl-9-propyl-1,3,9-triazaspiro[4.6]undec-2-en-2-amine
CID 79520778
1-cyclopentyl-5-(2-ethoxyphenyl)-5-methyl-4H-imidazol-2-amine
CID 79502964
1-(4-bromophenyl)-5-methyl-5-pentyl-4H-imidazol-2-amine
CID 80560168
1-(4-chlorophenyl)-5-hexyl-5-methyl-4H-imidazol-2-amine
CID 79521108
5-heptyl-5-methyl-1-(2-methylphenyl)-4H-imidazol-2-amine
CID 79500616
1-cyclopropyl-5-ethyl-5-(methoxymethyl)-4H-imidazol-2-amine
CID 79510430

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine?
The IUPAC name of 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine (CID 80560358) is 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine is CCCCCC1(C)CN=C(N)N1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine?
The InChIKey is WMORVMAPGIVAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-3-4-7-10-14(2)11-16-13(15)17(14)12-8-5-6-9-12/h12H,3-11H2,1-2H3,(H2,15,16).
What are the key properties of 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine?
1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine has a molecular weight of 237.39 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-5-methyl-5-pentyl-4H-imidazol-2-amine is sourced from PubChem (CID 80560358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).