N,N-didecyl-9H-fluoren-1-amine

C33H51N — CID 151349271

IUPACN,N-didecyl-9H-fluoren-1-amine
SMILESCCCCCCCCCCN(CCCCCCCCCC)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C33H51N/c1-3-5-7-9-11-13-15-19-26-34(27-20-16-14-12-10-8-6-4-2)33-25-21-24-31-30-23-18-17-22-29(30)28-32(31)33/h17-18,21-25H,3-16,19-20,26-28H2,1-2H3
InChIKeyOMDBYQJKPLZXBL-UHFFFAOYSA-N
MW461.78 g/mol
LogP10.35
Rot. Bonds19

About N,N-didecyl-9H-fluoren-1-amine

N,N-didecyl-9H-fluoren-1-amine (PubChem CID 151349271) has the molecular formula C33H51N and a molecular weight of 461.78 g/mol. Its IUPAC name is N,N-didecyl-9H-fluoren-1-amine.

Molecular Properties

Compound NameN,N-didecyl-9H-fluoren-1-amine
PubChem CID151349271
Molecular FormulaC33H51N
Molecular Weight461.78 g/mol
Exact Mass461.40
IUPAC NameN,N-didecyl-9H-fluoren-1-amine
SMILESCCCCCCCCCCN(CCCCCCCCCC)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C33H51N/c1-3-5-7-9-11-13-15-19-26-34(27-20-16-14-12-10-8-6-4-2)33-25-21-24-31-30-23-18-17-22-29(30)28-32(31)33/h17-18,21-25H,3-16,19-20,26-28H2,1-2H3
InChIKeyOMDBYQJKPLZXBL-UHFFFAOYSA-N
XLogP10.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.78
LogP ≤ 510.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(9H-fluoren-1-yl)-N-tetradecyl-9H-fluoren-1-amine
CID 150228680
4-N,4-N,5-N,5-N-tetraheptyl-9H-fluorene-4,5-diamine
CID 67058500
N,N-dihexyl-5,6,7,8-tetrahydronaphthalen-1-amine
CID 176916059
9H-fluorene;henicosane
CID 174789372
N,N-dimethylbutan-1-amine;9H-fluoren-1-ol
CID 67975331
1-hept-1-en-2-yl-9H-fluorene
CID 90871277
2-[3-[2-(dipentylamino)phenyl]phenyl]-N,N-dipentylaniline
CID 126582498
1-(9H-fluoren-1-yl)hexadecan-1-one
CID 139905434
bis(9H-fluorene);pentane
CID 159146463
2-(dioctadecylamino)phenol
CID 67178725
1-N,1-N,2-N,2-N-tetrapentyl-3-phenylbenzene-1,2-diamine
CID 69085127
N-(9H-fluoren-1-yl)-N-propylprop-2-enamide
CID 150861275

Frequently Asked Questions

What is the IUPAC name of N,N-didecyl-9H-fluoren-1-amine?
The IUPAC name of N,N-didecyl-9H-fluoren-1-amine (CID 151349271) is N,N-didecyl-9H-fluoren-1-amine.
What is the SMILES notation for N,N-didecyl-9H-fluoren-1-amine?
The canonical SMILES for N,N-didecyl-9H-fluoren-1-amine is CCCCCCCCCCN(CCCCCCCCCC)c1cccc2c1Cc1ccccc1-2.
What is the InChIKey of N,N-didecyl-9H-fluoren-1-amine?
The InChIKey is OMDBYQJKPLZXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H51N/c1-3-5-7-9-11-13-15-19-26-34(27-20-16-14-12-10-8-6-4-2)33-25-21-24-31-30-23-18-17-22-29(30)28-32(31)33/h17-18,21-25H,3-16,19-20,26-28H2,1-2H3.
What are the key properties of N,N-didecyl-9H-fluoren-1-amine?
N,N-didecyl-9H-fluoren-1-amine has a molecular weight of 461.78 g/mol, XLogP of 10.35, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-didecyl-9H-fluoren-1-amine is sourced from PubChem (CID 151349271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).