N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine

C14H25N3 — CID 81246388

IUPACN-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
SMILESCNCc1cnc(C)cc1N(C)CC(C)(C)C
InChIInChI=1S/C14H25N3/c1-11-7-13(12(8-15-5)9-16-11)17(6)10-14(2,3)4/h7,9,15H,8,10H2,1-6H3
InChIKeyQIQNMORPFBRLCT-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.59
Rot. Bonds4

About N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine

N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine (PubChem CID 81246388) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
PubChem CID81246388
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
SMILESCNCc1cnc(C)cc1N(C)CC(C)(C)C
InChIInChI=1S/C14H25N3/c1-11-7-13(12(8-15-5)9-16-11)17(6)10-14(2,3)4/h7,9,15H,8,10H2,1-6H3
InChIKeyQIQNMORPFBRLCT-UHFFFAOYSA-N
XLogP2.59
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine (CID 81246388) is N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine is CNCc1cnc(C)cc1N(C)CC(C)(C)C.
What is the InChIKey of N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine?
The InChIKey is QIQNMORPFBRLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-11-7-13(12(8-15-5)9-16-11)17(6)10-14(2,3)4/h7,9,15H,8,10H2,1-6H3.
What are the key properties of N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine?
N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine has a molecular weight of 235.37 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine is sourced from PubChem (CID 81246388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).