2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol

C17H25N3O — CID 115971231

IUPAC2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol
SMILESCCCc1nc2ccccc2n1CC(CO)(NC)C1CC1
InChIInChI=1S/C17H25N3O/c1-3-6-16-19-14-7-4-5-8-15(14)20(16)11-17(12-21,18-2)13-9-10-13/h4-5,7-8,13,18,21H,3,6,9-12H2,1-2H3
InChIKeyXSORWLPWMGBRTA-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.35
Rot. Bonds7

About 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol

2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol (PubChem CID 115971231) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol
PubChem CID115971231
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol
SMILESCCCc1nc2ccccc2n1CC(CO)(NC)C1CC1
InChIInChI=1S/C17H25N3O/c1-3-6-16-19-14-7-4-5-8-15(14)20(16)11-17(12-21,18-2)13-9-10-13/h4-5,7-8,13,18,21H,3,6,9-12H2,1-2H3
InChIKeyXSORWLPWMGBRTA-UHFFFAOYSA-N
XLogP2.35
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propanoic acid
CID 115970892
2-(ethylamino)-2-methyl-4-(2-propylbenzimidazol-1-yl)butan-1-ol
CID 115971235
2-cyclopropyl-3-indazol-1-yl-2-(methylamino)propan-1-ol
CID 64808985
1-cyclopentyl-2-(2-propylbenzimidazol-1-yl)ethanone
CID 104751637
N-methyl-2-[(2-propylbenzimidazol-1-yl)methyl]pyridin-4-amine
CID 115971040
N-[2-(2-propylbenzimidazol-1-yl)ethyl]cyclopentanamine
CID 115971115
2-propyl-1-(pyrimidin-2-ylmethyl)benzimidazole
CID 116626997
ethane;2-(1-ethylbenzimidazol-2-yl)ethanol
CID 142101886
1-(piperidin-4-ylmethyl)-2-propylbenzimidazole
CID 82149668
N-cyclohexyl-2-(2-propylbenzimidazol-1-yl)acetamide
CID 17028657
N-[2-(1-butylbenzimidazol-2-yl)ethyl]cyclopropanecarboxamide
CID 16975142
1-cyclopropyl-N-[2-(2-propylbenzimidazol-1-yl)ethyl]ethanamine
CID 115971092

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol (CID 115971231) is 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol is CCCc1nc2ccccc2n1CC(CO)(NC)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol?
The InChIKey is XSORWLPWMGBRTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-3-6-16-19-14-7-4-5-8-15(14)20(16)11-17(12-21,18-2)13-9-10-13/h4-5,7-8,13,18,21H,3,6,9-12H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol?
2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol has a molecular weight of 287.41 g/mol, XLogP of 2.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propan-1-ol is sourced from PubChem (CID 115971231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).