1-(9H-carbazol-3-yl)-3-methylbutan-1-ol

C17H19NO — CID 61087531

IUPAC1-(9H-carbazol-3-yl)-3-methylbutan-1-ol
SMILESCC(C)CC(O)c1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C17H19NO/c1-11(2)9-17(19)12-7-8-16-14(10-12)13-5-3-4-6-15(13)18-16/h3-8,10-11,17-19H,9H2,1-2H3
InChIKeyVUVJGTOBZJAKHV-UHFFFAOYSA-N
MW253.34 g/mol
LogP4.40
Rot. Bonds3

About 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol

1-(9H-carbazol-3-yl)-3-methylbutan-1-ol (PubChem CID 61087531) has the molecular formula C17H19NO and a molecular weight of 253.34 g/mol. Its IUPAC name is 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol.

Molecular Properties

Compound Name1-(9H-carbazol-3-yl)-3-methylbutan-1-ol
PubChem CID61087531
Molecular FormulaC17H19NO
Molecular Weight253.34 g/mol
Exact Mass253.15
IUPAC Name1-(9H-carbazol-3-yl)-3-methylbutan-1-ol
SMILESCC(C)CC(O)c1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C17H19NO/c1-11(2)9-17(19)12-7-8-16-14(10-12)13-5-3-4-6-15(13)18-16/h3-8,10-11,17-19H,9H2,1-2H3
InChIKeyVUVJGTOBZJAKHV-UHFFFAOYSA-N
XLogP4.40
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(9H-carbazol-3-yl)-4-methylpentan-1-ol
CID 61088469
1-(9H-carbazol-3-yl)propan-1-ol
CID 61087342
1-(9H-carbazol-3-yl)hexan-1-ol
CID 61088660
1-(9H-carbazol-3-yl)-N-ethyl-3-methylbutan-1-amine
CID 43490923
1-(9H-carbazol-3-yl)-4-methylpentan-1-amine
CID 43096739
1-(9H-carbazol-3-yl)-N-methylethanamine
CID 43483946
1-(9H-carbazol-3-yl)-N,4-dimethylpentan-1-amine
CID 43483949
4-amino-1-(9H-carbazol-3-yl)butane-1,2-diol
CID 171882250
methyl 2-(9H-carbazol-3-yl)-2-hydroxyacetate
CID 117390881
1-(9H-carbazol-3-yl)-4-(methylamino)butane-1,2-diol
CID 171891210
3-methyl-1-naphthalen-2-ylbutan-1-ol
CID 62717256
9H-carbazol-3-yl-(5-methylfuran-2-yl)methanol
CID 61089235

Frequently Asked Questions

What is the IUPAC name of 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol?
The IUPAC name of 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol (CID 61087531) is 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol.
What is the SMILES notation for 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol?
The canonical SMILES for 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol is CC(C)CC(O)c1ccc2[nH]c3ccccc3c2c1.
What is the InChIKey of 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol?
The InChIKey is VUVJGTOBZJAKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-11(2)9-17(19)12-7-8-16-14(10-12)13-5-3-4-6-15(13)18-16/h3-8,10-11,17-19H,9H2,1-2H3.
What are the key properties of 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol?
1-(9H-carbazol-3-yl)-3-methylbutan-1-ol has a molecular weight of 253.34 g/mol, XLogP of 4.40, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-carbazol-3-yl)-3-methylbutan-1-ol is sourced from PubChem (CID 61087531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).