N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine

C14H21Cl2N — CID 55195552

IUPACN-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine
SMILESCC(C)(C)NCC(C)(C)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H21Cl2N/c1-13(2,3)17-9-14(4,5)12-10(15)7-6-8-11(12)16/h6-8,17H,9H2,1-5H3
InChIKeyRBTPJNAJVUJXTD-UHFFFAOYSA-N
MW274.23 g/mol
LogP4.66
Rot. Bonds3

About N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine

N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine (PubChem CID 55195552) has the molecular formula C14H21Cl2N and a molecular weight of 274.23 g/mol. Its IUPAC name is N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine
PubChem CID55195552
Molecular FormulaC14H21Cl2N
Molecular Weight274.23 g/mol
Exact Mass273.11
IUPAC NameN-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine
SMILESCC(C)(C)NCC(C)(C)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H21Cl2N/c1-13(2,3)17-9-14(4,5)12-10(15)7-6-8-11(12)16/h6-8,17H,9H2,1-5H3
InChIKeyRBTPJNAJVUJXTD-UHFFFAOYSA-N
XLogP4.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.23
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butyl-2-(3-chloro-2-fluorophenyl)-2-methylpropan-1-amine
CID 82806549
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide
CID 119319554
1-(tert-butylamino)-3-(2,6-dichlorophenyl)-2-methylpropan-2-ol
CID 66038942
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119319553
4-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]pentanamide
CID 120562379
2-(2-chloro-6-fluorophenyl)-N-ethyl-2-methylpropan-1-amine
CID 62596396
1-(tert-butylamino)-2-(2-chlorophenyl)propan-2-ol
CID 62773407
2-(2,6-dichlorophenyl)propane-2-thiol
CID 146376660
4-[[2-(2,6-dichlorophenyl)-2-methylpropyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120673517
2-(2,6-dichlorophenyl)-N-(1H-imidazol-2-ylmethyl)-2-methylpropan-1-amine
CID 119126147
N-[(2,3-dichlorophenyl)methyl]-2-methylpropan-2-amine;hydrochloride
CID 17293607
N-tert-butyl-2-methyl-2-(3-methylphenyl)propan-1-amine
CID 62595182

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine?
The IUPAC name of N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine (CID 55195552) is N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine.
What is the SMILES notation for N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine?
The canonical SMILES for N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine is CC(C)(C)NCC(C)(C)c1c(Cl)cccc1Cl.
What is the InChIKey of N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine?
The InChIKey is RBTPJNAJVUJXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21Cl2N/c1-13(2,3)17-9-14(4,5)12-10(15)7-6-8-11(12)16/h6-8,17H,9H2,1-5H3.
What are the key properties of N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine?
N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine has a molecular weight of 274.23 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 55195552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).