N,N-dimethylpyridin-2-amine;triphenylborane

C25H25BN2 — CID 157357235

IUPACN,N-dimethylpyridin-2-amine;triphenylborane
SMILESCN(C)c1ccccn1.c1ccc(B(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15B.C7H10N2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(2)7-5-3-4-6-8-7/h1-15H;3-6H,1-2H3
InChIKeyBIFQBXFZIXURNB-UHFFFAOYSA-N
MW364.30 g/mol
LogP3.35
Rot. Bonds4

About N,N-dimethylpyridin-2-amine;triphenylborane

N,N-dimethylpyridin-2-amine;triphenylborane (PubChem CID 157357235) has the molecular formula C25H25BN2 and a molecular weight of 364.30 g/mol. Its IUPAC name is N,N-dimethylpyridin-2-amine;triphenylborane.

Molecular Properties

Compound NameN,N-dimethylpyridin-2-amine;triphenylborane
PubChem CID157357235
Molecular FormulaC25H25BN2
Molecular Weight364.30 g/mol
Exact Mass364.21
IUPAC NameN,N-dimethylpyridin-2-amine;triphenylborane
SMILESCN(C)c1ccccn1.c1ccc(B(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15B.C7H10N2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(2)7-5-3-4-6-8-7/h1-15H;3-6H,1-2H3
InChIKeyBIFQBXFZIXURNB-UHFFFAOYSA-N
XLogP3.35
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.30
LogP ≤ 53.35
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

N,N-dimethylpyridin-2-amine;molecular hydrogen
CID 143283394
N-[4-bis[4-(dipyridin-2-ylamino)phenyl]boranylphenyl]-N-pyridin-2-ylpyridin-2-amine
CID 71420299
N-methyl-N-pyridin-2-ylpyridin-2-amine
CID 14365053
N,N-dimethylpyridin-2-amine;piperidine
CID 140971036
sodium triphenylborane
CID 14535009
N,N-dimethylpyridin-2-amine;trifluoromethylsulfonyl 2,2,2-trifluoroacetate
CID 89407045
N-methyl-N-pyridin-2-ylmethanethioamide
CID 14095360
4-N-(4-diphenylboranylphenyl)-1-N,1-N,4-N-trimethylbenzene-1,4-diamine
CID 159627771
N-ethyl-N-methylpyridin-2-amine;hydrochloride
CID 175013921
N,N-bis(sulfanyl)pyridin-2-amine
CID 89305053
4-N-(4-diphenylboranylphenyl)-1-N,1-N,4-N-trimethylbenzene-1,4-diamine;ethane
CID 159627770
ethane;N'-methyl-N'-pyridin-2-ylmethanediamine
CID 91614077

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpyridin-2-amine;triphenylborane?
The IUPAC name of N,N-dimethylpyridin-2-amine;triphenylborane (CID 157357235) is N,N-dimethylpyridin-2-amine;triphenylborane.
What is the SMILES notation for N,N-dimethylpyridin-2-amine;triphenylborane?
The canonical SMILES for N,N-dimethylpyridin-2-amine;triphenylborane is CN(C)c1ccccn1.c1ccc(B(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N,N-dimethylpyridin-2-amine;triphenylborane?
The InChIKey is BIFQBXFZIXURNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15B.C7H10N2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-9(2)7-5-3-4-6-8-7/h1-15H;3-6H,1-2H3.
What are the key properties of N,N-dimethylpyridin-2-amine;triphenylborane?
N,N-dimethylpyridin-2-amine;triphenylborane has a molecular weight of 364.30 g/mol, XLogP of 3.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpyridin-2-amine;triphenylborane is sourced from PubChem (CID 157357235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).