N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine

C19H21NO — CID 90365428

IUPACN-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine
SMILESCC(C)c1ccc2c(c1)C(=NO)c1cc(C(C)C)ccc1-2
InChIInChI=1S/C19H21NO/c1-11(2)13-5-7-15-16-8-6-14(12(3)4)10-18(16)19(20-21)17(15)9-13/h5-12,21H,1-4H3
InChIKeyBFAOGJIGGHNMGU-UHFFFAOYSA-N
MW279.38 g/mol
LogP5.14
Rot. Bonds2

About N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine

N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine (PubChem CID 90365428) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine.

Molecular Properties

Compound NameN-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine
PubChem CID90365428
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine
SMILESCC(C)c1ccc2c(c1)C(=NO)c1cc(C(C)C)ccc1-2
InChIInChI=1S/C19H21NO/c1-11(2)13-5-7-15-16-8-6-14(12(3)4)10-18(16)19(20-21)17(15)9-13/h5-12,21H,1-4H3
InChIKeyBFAOGJIGGHNMGU-UHFFFAOYSA-N
XLogP5.14
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.38
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,4-dimethyl-6-propan-2-ylazulene
CID 19861187
(NE)-N-(7-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
CID 24808609
1,2-dimethyl-4-propan-2-ylbenzene;ethane
CID 142019921
sodium 4-methanidyl-1-methyl-7-propan-2-ylazulene
CID 71421135
4-(2-methyl-5-propan-2-ylphenyl)phenol
CID 151746189
5-methyl-16-propan-2-ylhexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene-8,13-dione
CID 89104255
2,4-di(propan-2-yl)-1-(4-propan-2-ylphenyl)benzene
CID 22103899
2,8-di(propan-2-yl)dibenzothiophene 5,5-dioxide
CID 121289541
2,6-di(propan-2-yl)naphthalene;ethane
CID 142320223
(2-methyl-5-propan-2-ylphenyl)methanethiol
CID 21131530
2-methyl-1-(3-propan-2-ylphenyl)propan-1-ol
CID 22486943
2,5-bis(4-propan-2-ylphenyl)benzene-1,4-diol
CID 121300355

Frequently Asked Questions

What is the IUPAC name of N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine?
The IUPAC name of N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine (CID 90365428) is N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine.
What is the SMILES notation for N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine?
The canonical SMILES for N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine is CC(C)c1ccc2c(c1)C(=NO)c1cc(C(C)C)ccc1-2.
What is the InChIKey of N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine?
The InChIKey is BFAOGJIGGHNMGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-11(2)13-5-7-15-16-8-6-14(12(3)4)10-18(16)19(20-21)17(15)9-13/h5-12,21H,1-4H3.
What are the key properties of N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine?
N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine has a molecular weight of 279.38 g/mol, XLogP of 5.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,7-di(propan-2-yl)fluoren-9-ylidene]hydroxylamine is sourced from PubChem (CID 90365428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).