1-(9H-carbazol-3-yl)-4-methylpentan-1-ol

C18H21NO — CID 61088469

IUPAC1-(9H-carbazol-3-yl)-4-methylpentan-1-ol
SMILESCC(C)CCC(O)c1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C18H21NO/c1-12(2)7-10-18(20)13-8-9-17-15(11-13)14-5-3-4-6-16(14)19-17/h3-6,8-9,11-12,18-20H,7,10H2,1-2H3
InChIKeyPYKPDVBNFYJDRK-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.79
Rot. Bonds4

About 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol

1-(9H-carbazol-3-yl)-4-methylpentan-1-ol (PubChem CID 61088469) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol.

Molecular Properties

Compound Name1-(9H-carbazol-3-yl)-4-methylpentan-1-ol
PubChem CID61088469
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name1-(9H-carbazol-3-yl)-4-methylpentan-1-ol
SMILESCC(C)CCC(O)c1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C18H21NO/c1-12(2)7-10-18(20)13-8-9-17-15(11-13)14-5-3-4-6-16(14)19-17/h3-6,8-9,11-12,18-20H,7,10H2,1-2H3
InChIKeyPYKPDVBNFYJDRK-UHFFFAOYSA-N
XLogP4.79
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(9H-carbazol-3-yl)-3-methylbutan-1-ol
CID 61087531
1-(9H-carbazol-3-yl)hexan-1-ol
CID 61088660
1-(9H-carbazol-3-yl)propan-1-ol
CID 61087342
1-(9H-carbazol-3-yl)-4-methylpentan-1-amine
CID 43096739
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
1-(9H-carbazol-3-yl)-4-(methylamino)butane-1,2-diol
CID 171891210
1-(9H-carbazol-3-yl)-N-methylethanamine
CID 43483946
1-(9H-carbazol-3-yl)-N-ethyl-3-methylbutan-1-amine
CID 43490923
methyl 2-(9H-carbazol-3-yl)-2-hydroxyacetate
CID 117390881
1-(9H-carbazol-3-yl)-N-methylbutan-1-amine
CID 43483944
3-[4-(2-methylpropyl)phenyl]-9H-carbazole
CID 66615207

Frequently Asked Questions

What is the IUPAC name of 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol?
The IUPAC name of 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol (CID 61088469) is 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol.
What is the SMILES notation for 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol?
The canonical SMILES for 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol is CC(C)CCC(O)c1ccc2[nH]c3ccccc3c2c1.
What is the InChIKey of 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol?
The InChIKey is PYKPDVBNFYJDRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-12(2)7-10-18(20)13-8-9-17-15(11-13)14-5-3-4-6-16(14)19-17/h3-6,8-9,11-12,18-20H,7,10H2,1-2H3.
What are the key properties of 1-(9H-carbazol-3-yl)-4-methylpentan-1-ol?
1-(9H-carbazol-3-yl)-4-methylpentan-1-ol has a molecular weight of 267.37 g/mol, XLogP of 4.79, 4 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)-4-methylpentan-1-ol is sourced from PubChem (CID 61088469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).