2,2-dimethyl-1-(4-propylphenyl)propan-1-amine

C14H23N — CID 43198125

IUPAC2,2-dimethyl-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(N)C(C)(C)C)cc1
InChIInChI=1S/C14H23N/c1-5-6-11-7-9-12(10-8-11)13(15)14(2,3)4/h7-10,13H,5-6,15H2,1-4H3
InChIKeyGQWVUFMKSSDMOW-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.68
Rot. Bonds3

About 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine

2,2-dimethyl-1-(4-propylphenyl)propan-1-amine (PubChem CID 43198125) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(4-propylphenyl)propan-1-amine
PubChem CID43198125
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name2,2-dimethyl-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(N)C(C)(C)C)cc1
InChIInChI=1S/C14H23N/c1-5-6-11-7-9-12(10-8-11)13(15)14(2,3)4/h7-10,13H,5-6,15H2,1-4H3
InChIKeyGQWVUFMKSSDMOW-UHFFFAOYSA-N
XLogP3.68
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-N,2-N,2-trimethyl-1-(4-propylphenyl)propane-1,2-diamine
CID 79054269
(1S)-1-(4-propylphenyl)ethanamine
CID 7047688
2,2-dimethyl-1-[4-(2-methylpropyl)phenyl]propan-1-amine
CID 43093450
2-amino-2-(4-propylphenyl)acetonitrile
CID 90203158
ethyl 2-amino-3-[4-(1-amino-2,2-dimethylpropyl)phenyl]propanoate
CID 69334174
3,5,5-trimethyl-1-(4-propylphenyl)hexan-1-amine
CID 43138780
N'-methyl-N'-(3-methylbutan-2-yl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43569993
2-methyl-1-(4-propylphenyl)propane-1,2-diol
CID 103449002
1,2-bis(4-propylphenyl)ethane-1,2-dithiol
CID 101102622
2,2-dimethyl-1-[4-(2-methylbutan-2-yl)phenyl]propan-1-amine
CID 66259173
3,3-dimethyl-1-(4-propylphenoxy)butan-2-amine
CID 62548208
2-amino-2-(4-propylphenyl)acetamide
CID 116850738

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine (CID 43198125) is 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine is CCCc1ccc(C(N)C(C)(C)C)cc1.
What is the InChIKey of 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine?
The InChIKey is GQWVUFMKSSDMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-5-6-11-7-9-12(10-8-11)13(15)14(2,3)4/h7-10,13H,5-6,15H2,1-4H3.
What are the key properties of 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine?
2,2-dimethyl-1-(4-propylphenyl)propan-1-amine has a molecular weight of 205.34 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(4-propylphenyl)propan-1-amine is sourced from PubChem (CID 43198125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).