N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine

C12H20N2 — CID 66271629

IUPACN,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine
SMILESCNC(c1cnccc1C)C(C)(C)C
InChIInChI=1S/C12H20N2/c1-9-6-7-14-8-10(9)11(13-5)12(2,3)4/h6-8,11,13H,1-5H3
InChIKeySEGIZMFQKHZNDV-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.70
Rot. Bonds2

About N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine

N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine (PubChem CID 66271629) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine
PubChem CID66271629
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC NameN,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine
SMILESCNC(c1cnccc1C)C(C)(C)C
InChIInChI=1S/C12H20N2/c1-9-6-7-14-8-10(9)11(13-5)12(2,3)4/h6-8,11,13H,1-5H3
InChIKeySEGIZMFQKHZNDV-UHFFFAOYSA-N
XLogP2.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2,2-dimethyl-1-(4-methyl-3-pyridinyl)propyl]hydrazine
CID 105203072
1-N,2-N,2-N,2-tetramethyl-1-(4-methyl-3-pyridinyl)propane-1,2-diamine
CID 79053905
1-(3-chloro-4-pyridinyl)-N,2,2-trimethylpropan-1-amine
CID 105146074
N,3,4,4-tetramethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
CID 105006583
N,2-dimethyl-1-(4-methyl-3-pyridinyl)-2-piperidin-1-ylbutan-1-amine
CID 79065903
N,4,4-trimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
CID 114878064
1-(2,5-dimethylphenyl)-N,2,2-trimethylpropan-1-amine
CID 43483759
3,3-dimethyl-1-(4-methyl-3-pyridinyl)butane-1,2-diol
CID 103457204
N-methyl-1-(4-methyl-3-pyridinyl)-1-(2,4,5-trimethylphenyl)methanamine
CID 114878144
2,2,2-trifluoro-N-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]ethanamine
CID 102709994
3-[(1R)-1-bromoethyl]-4-methylpyridine
CID 124706368
1-(4-methyl-3-pyridinyl)ethanamine
CID 64988869

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine?
The IUPAC name of N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine (CID 66271629) is N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine?
The canonical SMILES for N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine is CNC(c1cnccc1C)C(C)(C)C.
What is the InChIKey of N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine?
The InChIKey is SEGIZMFQKHZNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-9-6-7-14-8-10(9)11(13-5)12(2,3)4/h6-8,11,13H,1-5H3.
What are the key properties of N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine?
N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine has a molecular weight of 192.31 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-1-(4-methyl-3-pyridinyl)propan-1-amine is sourced from PubChem (CID 66271629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).