(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol

C17H18N2O — CID 799402

IUPAC(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol
SMILESCC(C)n1c([C@H](O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C17H18N2O/c1-12(2)19-15-11-7-6-10-14(15)18-17(19)16(20)13-8-4-3-5-9-13/h3-12,16,20H,1-2H3/t16-/m1/s1
InChIKeyCCGMKVCKAXTOGX-MRXNPFEDSA-N
MW266.34 g/mol
LogP3.70
Rot. Bonds3

About (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol

(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol (PubChem CID 799402) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol.

Molecular Properties

Compound Name(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol
PubChem CID799402
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol
SMILESCC(C)n1c([C@H](O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C17H18N2O/c1-12(2)19-15-11-7-6-10-14(15)18-17(19)16(20)13-8-4-3-5-9-13/h3-12,16,20H,1-2H3/t16-/m1/s1
InChIKeyCCGMKVCKAXTOGX-MRXNPFEDSA-N
XLogP3.70
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(S)-(1-propan-2-ylbenzimidazol-2-yl)-(4-propan-2-ylphenyl)methanol
CID 929475
(1R)-1-(1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 25315233
2-[(1R)-1-chloroethyl]-1-propan-2-ylbenzimidazole
CID 93257413
(1R)-1-(1-propan-2-ylbenzimidazol-2-yl)ethanamine;hydrochloride
CID 133143586
1-(1-phenylethyl)-2-propan-2-ylbenzimidazole
CID 3623918
(1-methylbenzimidazol-2-yl)-(4-propan-2-ylphenyl)methanol
CID 2891070
(1R)-1-[1-[(1S)-1-phenylethyl]benzimidazol-2-yl]propan-1-ol
CID 40692444
2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propan-1-amine;hydrochloride
CID 122169362
(R)-(1-benzylbenzimidazol-2-yl)-(4-propan-2-ylphenyl)methanol
CID 7007591
(R)-[1-(2-methoxyethyl)benzimidazol-2-yl]-phenylmethanol
CID 40699008
(1S)-1-[1-(difluoromethyl)benzimidazol-2-yl]ethanol
CID 7042738
2-(diethoxymethyl)-1-propan-2-ylbenzimidazole
CID 63772166

Frequently Asked Questions

What is the IUPAC name of (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol?
The IUPAC name of (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol (CID 799402) is (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol.
What is the SMILES notation for (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol?
The canonical SMILES for (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol is CC(C)n1c([C@H](O)c2ccccc2)nc2ccccc21.
What is the InChIKey of (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol?
The InChIKey is CCGMKVCKAXTOGX-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H18N2O/c1-12(2)19-15-11-7-6-10-14(15)18-17(19)16(20)13-8-4-3-5-9-13/h3-12,16,20H,1-2H3/t16-/m1/s1.
What are the key properties of (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol?
(R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol has a molecular weight of 266.34 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-phenyl-(1-propan-2-ylbenzimidazol-2-yl)methanol is sourced from PubChem (CID 799402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).