N-(3-methyloctan-3-yl)pyridin-4-amine

C14H24N2 — CID 134415197

IUPACN-(3-methyloctan-3-yl)pyridin-4-amine
SMILESCCCCCC(C)(CC)Nc1ccncc1
InChIInChI=1S/C14H24N2/c1-4-6-7-10-14(3,5-2)16-13-8-11-15-12-9-13/h8-9,11-12H,4-7,10H2,1-3H3,(H,15,16)
InChIKeyBTWATQIKRRBEIC-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.24
Rot. Bonds7

About N-(3-methyloctan-3-yl)pyridin-4-amine

N-(3-methyloctan-3-yl)pyridin-4-amine (PubChem CID 134415197) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N-(3-methyloctan-3-yl)pyridin-4-amine.

Molecular Properties

Compound NameN-(3-methyloctan-3-yl)pyridin-4-amine
PubChem CID134415197
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN-(3-methyloctan-3-yl)pyridin-4-amine
SMILESCCCCCC(C)(CC)Nc1ccncc1
InChIInChI=1S/C14H24N2/c1-4-6-7-10-14(3,5-2)16-13-8-11-15-12-9-13/h8-9,11-12H,4-7,10H2,1-3H3,(H,15,16)
InChIKeyBTWATQIKRRBEIC-UHFFFAOYSA-N
XLogP4.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-2-N-pyridin-4-ylbutane-1,2-diamine
CID 64549693
N-(3-methyldecan-3-yl)pyrimidin-2-amine
CID 155123282
N-(4-methyldecan-4-yl)aniline
CID 166741267
2,2-dimethyl-N-(pyridin-4-ylmethyl)heptanamide
CID 135208415
2-methyl-2-N-(4-methylphenyl)octane-1,2-diamine
CID 65377345
2-N-(4-fluorophenyl)-2-methylheptane-1,2-diamine
CID 80557635
4-(5-methylundecan-5-yl)pyridine
CID 146178387
N-[1-chloro-2-(chloromethyl)butan-2-yl]pyridin-4-amine
CID 107867330
4-(aminomethyl)-N-(3-methylhexan-3-yl)aniline
CID 174182706
N-(2-methyltridecan-2-yl)aniline
CID 67784312
N-(15,15-dimethylhexadecyl)pyridin-4-amine
CID 173437597
N-(2-bromo-4-pyridinyl)-2-hydroxy-2-methylheptanamide
CID 71558084

Frequently Asked Questions

What is the IUPAC name of N-(3-methyloctan-3-yl)pyridin-4-amine?
The IUPAC name of N-(3-methyloctan-3-yl)pyridin-4-amine (CID 134415197) is N-(3-methyloctan-3-yl)pyridin-4-amine.
What is the SMILES notation for N-(3-methyloctan-3-yl)pyridin-4-amine?
The canonical SMILES for N-(3-methyloctan-3-yl)pyridin-4-amine is CCCCCC(C)(CC)Nc1ccncc1.
What is the InChIKey of N-(3-methyloctan-3-yl)pyridin-4-amine?
The InChIKey is BTWATQIKRRBEIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-4-6-7-10-14(3,5-2)16-13-8-11-15-12-9-13/h8-9,11-12H,4-7,10H2,1-3H3,(H,15,16).
What are the key properties of N-(3-methyloctan-3-yl)pyridin-4-amine?
N-(3-methyloctan-3-yl)pyridin-4-amine has a molecular weight of 220.36 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyloctan-3-yl)pyridin-4-amine is sourced from PubChem (CID 134415197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).