N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine

C13H19BN2 — CID 15872798

IUPACN-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine
SMILESCN(C)B(C1C=Cc2ccccc21)N(C)C
InChIInChI=1S/C13H19BN2/c1-15(2)14(16(3)4)13-10-9-11-7-5-6-8-12(11)13/h5-10,13H,1-4H3
InChIKeyHZIKLNAQLULMRQ-UHFFFAOYSA-N
MW214.12 g/mol
LogP1.95
Rot. Bonds3

About N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine

N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine (PubChem CID 15872798) has the molecular formula C13H19BN2 and a molecular weight of 214.12 g/mol. Its IUPAC name is N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine
PubChem CID15872798
Molecular FormulaC13H19BN2
Molecular Weight214.12 g/mol
Exact Mass214.16
IUPAC NameN-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine
SMILESCN(C)B(C1C=Cc2ccccc21)N(C)C
InChIInChI=1S/C13H19BN2/c1-15(2)14(16(3)4)13-10-9-11-7-5-6-8-12(11)13/h5-10,13H,1-4H3
InChIKeyHZIKLNAQLULMRQ-UHFFFAOYSA-N
XLogP1.95
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.12
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[[bis(trimethylsilyl)amino]-(1H-inden-1-yl)boranyl]-1H-indene
CID 12011470
cyclopenta-2,4-dien-1-yl-(1H-inden-1-yl)-phenylborane
CID 131721399
N-methyl-N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaen-2-amine
CID 102513812
cyclopenta-1,2,4-trien-1-yl-bis(1H-inden-1-yl)borane
CID 177429628
1-(2-hydroxy-1,2-dihydronaphthalen-1-yl)-1,2-dihydronaphthalen-2-ol
CID 71289286
2-[(1S)-1H-inden-1-yl]-N,N-dimethyl-2-oxoacetamide
CID 98521083
CID 54557103
CID 54557103
1H-inden-1-amine
CID 14298803
1H-inden-1-yl(trimethyl)plumbane
CID 23269464
bis(1H-inden-1-yl)-dimethylsilane
CID 599429
(1S,2R)-2-methyl-1,2-dihydronaphthalene-1-carbaldehyde
CID 10749718
CID 173308465
CID 173308465

Frequently Asked Questions

What is the IUPAC name of N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine?
The IUPAC name of N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine (CID 15872798) is N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine.
What is the SMILES notation for N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine?
The canonical SMILES for N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine is CN(C)B(C1C=Cc2ccccc21)N(C)C.
What is the InChIKey of N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine?
The InChIKey is HZIKLNAQLULMRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BN2/c1-15(2)14(16(3)4)13-10-9-11-7-5-6-8-12(11)13/h5-10,13H,1-4H3.
What are the key properties of N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine?
N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine has a molecular weight of 214.12 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethylamino(1H-inden-1-yl)boranyl]-N-methylmethanamine is sourced from PubChem (CID 15872798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).