1-(9H-fluoren-3-yl)-N-methylbutan-1-amine

C18H21N — CID 43483862

IUPAC1-(9H-fluoren-3-yl)-N-methylbutan-1-amine
SMILESCCCC(NC)c1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C18H21N/c1-3-6-18(19-2)15-10-9-14-11-13-7-4-5-8-16(13)17(14)12-15/h4-5,7-10,12,18-19H,3,6,11H2,1-2H3
InChIKeyOLTBGUSEZHHABB-UHFFFAOYSA-N
MW251.37 g/mol
LogP4.32
Rot. Bonds4

About 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine

1-(9H-fluoren-3-yl)-N-methylbutan-1-amine (PubChem CID 43483862) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine.

Molecular Properties

Compound Name1-(9H-fluoren-3-yl)-N-methylbutan-1-amine
PubChem CID43483862
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name1-(9H-fluoren-3-yl)-N-methylbutan-1-amine
SMILESCCCC(NC)c1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C18H21N/c1-3-6-18(19-2)15-10-9-14-11-13-7-4-5-8-16(13)17(14)12-15/h4-5,7-10,12,18-19H,3,6,11H2,1-2H3
InChIKeyOLTBGUSEZHHABB-UHFFFAOYSA-N
XLogP4.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol
CID 64814899
N-methyl-1-(4-phenoxyphenyl)butan-1-amine
CID 19069357
(1R)-N-methyl-1-(4-phenoxyphenyl)butan-1-amine
CID 54006451
1-(3-fluoro-4-methylphenyl)-N-methylbutan-1-amine
CID 60819926
nonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4(16),5,8,10,12,14,19,21(33),22,25,27,29,31-pentadecaene
CID 59863436
(2S)-2-amino-2-(9H-fluoren-3-yl)ethanol
CID 66515165
bis(9H-fluorene);pentane
CID 159146463
1-(9H-carbazol-3-yl)-N-methylbutan-1-amine
CID 43483944
pentakis(N-ethylethanamine);9H-fluorene
CID 172860190
3-ethylpentane;bis(9H-fluorene)
CID 161034043
bis(9H-fluorene);methane;pentane
CID 158815702
9H-fluorene;henicosane
CID 174789372

Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine?
The IUPAC name of 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine (CID 43483862) is 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine.
What is the SMILES notation for 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine?
The canonical SMILES for 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine is CCCC(NC)c1ccc2c(c1)-c1ccccc1C2.
What is the InChIKey of 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine?
The InChIKey is OLTBGUSEZHHABB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-3-6-18(19-2)15-10-9-14-11-13-7-4-5-8-16(13)17(14)12-15/h4-5,7-10,12,18-19H,3,6,11H2,1-2H3.
What are the key properties of 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine?
1-(9H-fluoren-3-yl)-N-methylbutan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-3-yl)-N-methylbutan-1-amine is sourced from PubChem (CID 43483862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).