N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline

C14H21N — CID 166727100

IUPACN,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline
SMILESCc1ccccc1N(C)C1(C)CC1(C)C
InChIInChI=1S/C14H21N/c1-11-8-6-7-9-12(11)15(5)14(4)10-13(14,2)3/h6-9H,10H2,1-5H3
InChIKeyZTMLLFXMPXALGK-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.62
Rot. Bonds2

About N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline

N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline (PubChem CID 166727100) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline.

Molecular Properties

Compound NameN,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline
PubChem CID166727100
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline
SMILESCc1ccccc1N(C)C1(C)CC1(C)C
InChIInChI=1S/C14H21N/c1-11-8-6-7-9-12(11)15(5)14(4)10-13(14,2)3/h6-9H,10H2,1-5H3
InChIKeyZTMLLFXMPXALGK-UHFFFAOYSA-N
XLogP3.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline?
The IUPAC name of N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline (CID 166727100) is N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline.
What is the SMILES notation for N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline?
The canonical SMILES for N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline is Cc1ccccc1N(C)C1(C)CC1(C)C.
What is the InChIKey of N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline?
The InChIKey is ZTMLLFXMPXALGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11-8-6-7-9-12(11)15(5)14(4)10-13(14,2)3/h6-9H,10H2,1-5H3.
What are the key properties of N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline?
N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline has a molecular weight of 203.33 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline is sourced from PubChem (CID 166727100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).