2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine

C11H25N — CID 13497227

IUPAC2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine
SMILESCC(C)N(CC(C)(C)C)C(C)C
InChIInChI=1S/C11H25N/c1-9(2)12(10(3)4)8-11(5,6)7/h9-10H,8H2,1-7H3
InChIKeyJJTAYKNTEAHIAG-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.15
Rot. Bonds3

About 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine

2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine (PubChem CID 13497227) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine
PubChem CID13497227
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine
SMILESCC(C)N(CC(C)(C)C)C(C)C
InChIInChI=1S/C11H25N/c1-9(2)12(10(3)4)8-11(5,6)7/h9-10H,8H2,1-7H3
InChIKeyJJTAYKNTEAHIAG-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine (CID 13497227) is 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine is CC(C)N(CC(C)(C)C)C(C)C.
What is the InChIKey of 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine?
The InChIKey is JJTAYKNTEAHIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-9(2)12(10(3)4)8-11(5,6)7/h9-10H,8H2,1-7H3.
What are the key properties of 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine?
2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine has a molecular weight of 171.33 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N,N-di(propan-2-yl)propan-1-amine is sourced from PubChem (CID 13497227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).