N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine

C15H26N2 — CID 114212784

IUPACN,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine
SMILESCNC(CCC(C)(C)C)Cc1ncccc1C
InChIInChI=1S/C15H26N2/c1-12-7-6-10-17-14(12)11-13(16-5)8-9-15(2,3)4/h6-7,10,13,16H,8-9,11H2,1-5H3
InChIKeyUURNRXRVDYEVDY-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.35
Rot. Bonds5

About N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine

N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine (PubChem CID 114212784) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine.

Molecular Properties

Compound NameN,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine
PubChem CID114212784
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine
SMILESCNC(CCC(C)(C)C)Cc1ncccc1C
InChIInChI=1S/C15H26N2/c1-12-7-6-10-17-14(12)11-13(16-5)8-9-15(2,3)4/h6-7,10,13,16H,8-9,11H2,1-5H3
InChIKeyUURNRXRVDYEVDY-UHFFFAOYSA-N
XLogP3.35
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,5-dimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine
CID 66446876
1-(3-methyl-2-pyridinyl)-N-propylpentan-2-amine
CID 63198506
N,6,6-trimethyl-1-(2-methylphenyl)heptan-3-amine
CID 105140044
1-(3-methyl-2-pyridinyl)-N-propylbutan-2-amine
CID 63202116
2-(2-bromo-5-methylhexyl)-3-methylpyridine
CID 66455289
2-(2-bromotridecyl)-3-methylpyridine
CID 66452472
1-(4-fluorophenyl)-N-methyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 66447073
N-ethyl-1,1,1-trifluoro-3-(3-methyl-2-pyridinyl)propan-2-amine
CID 66447078
1-(3,4-dichlorophenyl)-N-methyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 66446677
2-(2-bromo-4-phenylbutyl)-3-methylpyridine
CID 66453126
1-(2-methoxyphenyl)-N,5,5-trimethylhexan-2-amine
CID 62601026
2,4,4-trimethyl-N-[(3-methyl-2-pyridinyl)methyl]pentan-2-amine
CID 112550264

Frequently Asked Questions

What is the IUPAC name of N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine?
The IUPAC name of N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine (CID 114212784) is N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine.
What is the SMILES notation for N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine?
The canonical SMILES for N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine is CNC(CCC(C)(C)C)Cc1ncccc1C.
What is the InChIKey of N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine?
The InChIKey is UURNRXRVDYEVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-12-7-6-10-17-14(12)11-13(16-5)8-9-15(2,3)4/h6-7,10,13,16H,8-9,11H2,1-5H3.
What are the key properties of N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine?
N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine has a molecular weight of 234.39 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,5-trimethyl-1-(3-methyl-2-pyridinyl)hexan-2-amine is sourced from PubChem (CID 114212784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).