2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine

C15H26N2 — CID 112550264

IUPAC2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine
SMILESCc1cccnc1CNC(C)(C)CC(C)(C)C
InChIInChI=1S/C15H26N2/c1-12-8-7-9-16-13(12)10-17-15(5,6)11-14(2,3)4/h7-9,17H,10-11H2,1-6H3
InChIKeyYWIXHLOLSSVPGK-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.69
Rot. Bonds4

About 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine

2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine (PubChem CID 112550264) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine.

Molecular Properties

Compound Name2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine
PubChem CID112550264
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine
SMILESCc1cccnc1CNC(C)(C)CC(C)(C)C
InChIInChI=1S/C15H26N2/c1-12-8-7-9-16-13(12)10-17-15(5,6)11-14(2,3)4/h7-9,17H,10-11H2,1-6H3
InChIKeyYWIXHLOLSSVPGK-UHFFFAOYSA-N
XLogP3.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

1-chloro-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]butan-2-amine
CID 112651368
2-(tert-butylamino)-N-[(3-methyl-2-pyridinyl)methyl]acetamide
CID 78942030
2-methyl-3-[(3-methyl-2-pyridinyl)methylamino]butan-2-ol
CID 65337637
2-ethoxy-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]propan-1-amine
CID 114942154
N-[(3-methyl-2-pyridinyl)methyl]-2-(trifluoromethyl)aniline
CID 55203857
2,4,4-trimethyl-N-(pyridin-3-ylmethyl)pentan-2-amine;hydrochloride
CID 6463081
2-methyl-1-(3-methyl-2-pyridinyl)propan-2-amine
CID 96849507
2-hydroxy-2-methyl-3-[(3-methyl-2-pyridinyl)methylamino]propanoic acid
CID 104644480
2-N-[(3-methyl-2-pyridinyl)methyl]benzene-1,2-diamine
CID 63305875
N-[(3-methyl-2-pyridinyl)methyl]thiophen-3-amine
CID 112650234
4-ethyl-N-[(3-methyl-2-pyridinyl)methyl]aniline
CID 112650022
5-methyl-N-[(3-methyl-2-pyridinyl)methyl]pyridin-2-amine
CID 63306403

Frequently Asked Questions

What is the IUPAC name of 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine?
The IUPAC name of 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine (CID 112550264) is 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine.
What is the SMILES notation for 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine?
The canonical SMILES for 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine is Cc1cccnc1CNC(C)(C)CC(C)(C)C.
What is the InChIKey of 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine?
The InChIKey is YWIXHLOLSSVPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-12-8-7-9-16-13(12)10-17-15(5,6)11-14(2,3)4/h7-9,17H,10-11H2,1-6H3.
What are the key properties of 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine?
2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine has a molecular weight of 234.39 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine is sourced from PubChem (CID 112550264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).