2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine

C15H26N2O — CID 79626684

IUPAC2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine
SMILESCC(C)NCC(C)(C)COCCc1ccccn1
InChIInChI=1S/C15H26N2O/c1-13(2)17-11-15(3,4)12-18-10-8-14-7-5-6-9-16-14/h5-7,9,13,17H,8,10-12H2,1-4H3
InChIKeyNHOYPUIAXMIKLZ-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.66
Rot. Bonds8

About 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine

2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine (PubChem CID 79626684) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine
PubChem CID79626684
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine
SMILESCC(C)NCC(C)(C)COCCc1ccccn1
InChIInChI=1S/C15H26N2O/c1-13(2)17-11-15(3,4)12-18-10-8-14-7-5-6-9-16-14/h5-7,9,13,17H,8,10-12H2,1-4H3
InChIKeyNHOYPUIAXMIKLZ-UHFFFAOYSA-N
XLogP2.66
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

N-propan-2-yl-5-(2-pyridin-2-ylethoxy)pentan-1-amine
CID 62455568
2-methyl-N-[2-(2-pyridin-2-ylethoxy)ethyl]propan-2-amine
CID 62456481
2,2-dimethyl-3-(2-pyridin-2-ylethoxy)propanehydrazide
CID 79628320
methyl 2,2-dimethyl-3-(2-pyridin-2-ylethoxy)propanoate
CID 79622873
2-methyl-1-(propylamino)-3-(2-pyridin-2-ylethoxy)propan-2-ol
CID 66336556
2,2-dimethyl-N-propan-2-yl-3-(2-propoxyphenoxy)propan-1-amine
CID 79627722
1-tert-butyl-4-[2-(2-pyridin-2-ylethoxy)ethyl]piperazine
CID 171718919
N-propan-2-yl-2-(2-pyridin-2-ylethoxy)pentan-1-amine
CID 83045178
2-[2-(ethoxymethoxy)ethyl]pyridine
CID 20729603
N-[[5-methyl-4-(2-pyridin-2-ylethoxymethyl)thiophen-2-yl]methyl]propan-2-amine
CID 80720105
2,2-dimethyl-3-naphthalen-2-yloxy-N-propan-2-ylpropan-1-amine
CID 79626422
3-(3-tert-butylphenoxy)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 79628807

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine?
The IUPAC name of 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine (CID 79626684) is 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine is CC(C)NCC(C)(C)COCCc1ccccn1.
What is the InChIKey of 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine?
The InChIKey is NHOYPUIAXMIKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-13(2)17-11-15(3,4)12-18-10-8-14-7-5-6-9-16-14/h5-7,9,13,17H,8,10-12H2,1-4H3.
What are the key properties of 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine?
2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 2.66, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-propan-2-yl-3-(2-pyridin-2-ylethoxy)propan-1-amine is sourced from PubChem (CID 79626684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).