N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine

C18H21N — CID 62919912

IUPACN-(2-methylpropyl)-9,10-dihydroanthracen-9-amine
SMILESCC(C)CNC1c2ccccc2Cc2ccccc21
InChIInChI=1S/C18H21N/c1-13(2)12-19-18-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3
InChIKeyAHJVSRHHBRFXFI-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.93
Rot. Bonds3

About N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine

N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine (PubChem CID 62919912) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-9,10-dihydroanthracen-9-amine
PubChem CID62919912
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC NameN-(2-methylpropyl)-9,10-dihydroanthracen-9-amine
SMILESCC(C)CNC1c2ccccc2Cc2ccccc21
InChIInChI=1S/C18H21N/c1-13(2)12-19-18-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3
InChIKeyAHJVSRHHBRFXFI-UHFFFAOYSA-N
XLogP3.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-prop-2-enyl-9,10-dihydroanthracen-9-amine
CID 62919908
N-(2,2-dimethylbutyl)-9,10-dihydroanthracen-9-amine
CID 103460480
N-(cyclobutylmethyl)-9,10-dihydroanthracen-9-amine
CID 62921103
N'-(9,10-dihydroanthracen-9-yl)propane-1,3-diamine
CID 55131389
(1R,2S)-1-(2-methylpropylamino)-2,3-dihydro-1H-inden-2-ol
CID 103880518
N-(4-methoxybutyl)-9,10-dihydroanthracen-9-amine
CID 62921270
N-(4-methoxybutan-2-yl)-9,10-dihydroanthracen-9-amine
CID 64605041
2-(9,10-dihydroanthracen-9-ylamino)propanoic acid
CID 62921269
N-(1,2-oxazol-3-ylmethyl)-9,10-dihydroanthracen-9-amine
CID 81176893
3-amino-1-(3-methylbutylamino)-3,4-dihydro-1H-naphthalen-2-one
CID 19995564
9-propan-2-yl-9,10-dihydroanthracene;9-propan-2-yl-9H-fluorene
CID 157296228
N-(9,10-dihydroanthracen-9-yl)thiophen-3-amine
CID 66350154

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine?
The IUPAC name of N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine (CID 62919912) is N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine.
What is the SMILES notation for N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine?
The canonical SMILES for N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine is CC(C)CNC1c2ccccc2Cc2ccccc21.
What is the InChIKey of N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine?
The InChIKey is AHJVSRHHBRFXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-13(2)12-19-18-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3.
What are the key properties of N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine?
N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine has a molecular weight of 251.37 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-9,10-dihydroanthracen-9-amine is sourced from PubChem (CID 62919912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).