5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole

C14H25N3 — CID 105497006

IUPAC5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole
SMILESCC(C)Cc1[nH]c(C2CCNC2)nc1C(C)C
InChIInChI=1S/C14H25N3/c1-9(2)7-12-13(10(3)4)17-14(16-12)11-5-6-15-8-11/h9-11,15H,5-8H2,1-4H3,(H,16,17)
InChIKeyGHFSANXSBZSXLO-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.81
Rot. Bonds4

About 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole

5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole (PubChem CID 105497006) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole.

Molecular Properties

Compound Name5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole
PubChem CID105497006
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole
SMILESCC(C)Cc1[nH]c(C2CCNC2)nc1C(C)C
InChIInChI=1S/C14H25N3/c1-9(2)7-12-13(10(3)4)17-14(16-12)11-5-6-15-8-11/h9-11,15H,5-8H2,1-4H3,(H,16,17)
InChIKeyGHFSANXSBZSXLO-UHFFFAOYSA-N
XLogP2.81
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-cyclopropyl-5-ethyl-2-pyrrolidin-3-yl-1H-imidazole
CID 105458221
4-tert-butyl-5-ethyl-2-pyrrolidin-3-yl-1H-imidazole
CID 105478440
(2-cyclohexyl-4-propan-2-yl-1H-imidazol-5-yl)methanamine
CID 82373843
2-(azetidin-3-yl)-5-cyclopentyl-4-propan-2-yl-1H-imidazole
CID 105493632
2-(azetidin-3-yl)-5-cyclobutyl-4-propan-2-yl-1H-imidazole
CID 105474943
3-(2-methylpropyl)-5-[(3S)-pyrrolidin-3-yl]-1,2,4-oxadiazole;hydrochloride
CID 130747832
5-methyl-4-propan-2-yl-2-pyrrolidin-3-yl-1,3-thiazole
CID 105464488
4-(2-methylpropyl)-5-piperidin-4-yl-1,3-dihydroimidazol-2-one
CID 84735534
2-propan-2-yl-5-pyrrolidin-3-yl-4H-1,2,4-triazol-3-one
CID 136982040
5-(2-methylpropyl)-4-propan-2-yl-1H-imidazole-2-carboxylic acid
CID 105464153
5-(2-methylpropyl)-4-pyrrolidin-3-ylpyrimidine
CID 82396174
1-(2-methylpropyl)-4-pyrrolidin-3-ylpyrazole
CID 105447574

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole?
The IUPAC name of 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole (CID 105497006) is 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole.
What is the SMILES notation for 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole?
The canonical SMILES for 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole is CC(C)Cc1[nH]c(C2CCNC2)nc1C(C)C.
What is the InChIKey of 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole?
The InChIKey is GHFSANXSBZSXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-9(2)7-12-13(10(3)4)17-14(16-12)11-5-6-15-8-11/h9-11,15H,5-8H2,1-4H3,(H,16,17).
What are the key properties of 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole?
5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole has a molecular weight of 235.38 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-4-propan-2-yl-2-pyrrolidin-3-yl-1H-imidazole is sourced from PubChem (CID 105497006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).