2-benzyl-N-(dicyclopropylmethyl)aniline

C20H23N — CID 43362769

IUPAC2-benzyl-N-(dicyclopropylmethyl)aniline
SMILESc1ccc(Cc2ccccc2NC(C2CC2)C2CC2)cc1
InChIInChI=1S/C20H23N/c1-2-6-15(7-3-1)14-18-8-4-5-9-19(18)21-20(16-10-11-16)17-12-13-17/h1-9,16-17,20-21H,10-14H2
InChIKeyJZIABFOIDKJSJY-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.88
Rot. Bonds6

About 2-benzyl-N-(dicyclopropylmethyl)aniline

2-benzyl-N-(dicyclopropylmethyl)aniline (PubChem CID 43362769) has the molecular formula C20H23N and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-benzyl-N-(dicyclopropylmethyl)aniline.

Molecular Properties

Compound Name2-benzyl-N-(dicyclopropylmethyl)aniline
PubChem CID43362769
Molecular FormulaC20H23N
Molecular Weight277.41 g/mol
Exact Mass277.18
IUPAC Name2-benzyl-N-(dicyclopropylmethyl)aniline
SMILESc1ccc(Cc2ccccc2NC(C2CC2)C2CC2)cc1
InChIInChI=1S/C20H23N/c1-2-6-15(7-3-1)14-18-8-4-5-9-19(18)21-20(16-10-11-16)17-12-13-17/h1-9,16-17,20-21H,10-14H2
InChIKeyJZIABFOIDKJSJY-UHFFFAOYSA-N
XLogP4.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-benzyl-N-propan-2-ylaniline
CID 13262632
2-benzyl-N-pentan-3-ylaniline
CID 29272087
N-(dicyclopropylmethyl)-2-(trifluoromethyl)aniline
CID 43362736
2-bromo-N-(dicyclopropylmethyl)aniline
CID 43362785
2-(2-benzylanilino)propanenitrile
CID 54941633
N-(2-benzylphenyl)hydroxylamine
CID 3014197
N-(2-benzylphenyl)thiohydroxylamine
CID 88608695
2-(2-benzylanilino)-N-methylpropanamide
CID 43085479
trans-(1R,2R)-2-(2-benzylanilino)cyclopentan-1-ol
CID 102732984
trans-(1R,2R)-2-(2-benzylanilino)cyclohexan-1-ol
CID 102730921
N-(dicyclopropylmethyl)-2-ethylsulfanylaniline
CID 54865167
2-N-(2-benzylphenyl)-1-N-ethylbutane-1,2-diamine
CID 143127936

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-(dicyclopropylmethyl)aniline?
The IUPAC name of 2-benzyl-N-(dicyclopropylmethyl)aniline (CID 43362769) is 2-benzyl-N-(dicyclopropylmethyl)aniline.
What is the SMILES notation for 2-benzyl-N-(dicyclopropylmethyl)aniline?
The canonical SMILES for 2-benzyl-N-(dicyclopropylmethyl)aniline is c1ccc(Cc2ccccc2NC(C2CC2)C2CC2)cc1.
What is the InChIKey of 2-benzyl-N-(dicyclopropylmethyl)aniline?
The InChIKey is JZIABFOIDKJSJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-2-6-15(7-3-1)14-18-8-4-5-9-19(18)21-20(16-10-11-16)17-12-13-17/h1-9,16-17,20-21H,10-14H2.
What are the key properties of 2-benzyl-N-(dicyclopropylmethyl)aniline?
2-benzyl-N-(dicyclopropylmethyl)aniline has a molecular weight of 277.41 g/mol, XLogP of 4.88, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-(dicyclopropylmethyl)aniline is sourced from PubChem (CID 43362769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).