N-methyl-6-pyridin-3-ylhexan-2-amine

C12H20N2 — CID 18177774

IUPACN-methyl-6-pyridin-3-ylhexan-2-amine
SMILESCNC(C)CCCCc1cccnc1
InChIInChI=1S/C12H20N2/c1-11(13-2)6-3-4-7-12-8-5-9-14-10-12/h5,8-11,13H,3-4,6-7H2,1-2H3
InChIKeyRBULXMMRRJDMGK-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.40
Rot. Bonds6

About N-methyl-6-pyridin-3-ylhexan-2-amine

N-methyl-6-pyridin-3-ylhexan-2-amine (PubChem CID 18177774) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is N-methyl-6-pyridin-3-ylhexan-2-amine.

Molecular Properties

Compound NameN-methyl-6-pyridin-3-ylhexan-2-amine
PubChem CID18177774
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC NameN-methyl-6-pyridin-3-ylhexan-2-amine
SMILESCNC(C)CCCCc1cccnc1
InChIInChI=1S/C12H20N2/c1-11(13-2)6-3-4-7-12-8-5-9-14-10-12/h5,8-11,13H,3-4,6-7H2,1-2H3
InChIKeyRBULXMMRRJDMGK-UHFFFAOYSA-N
XLogP2.40
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.40
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

3-(5-methylhexyl)pyridine
CID 54316004
3-(14-methylpentadecyl)pyridine
CID 19697272
3-(9-methyldodecyl)pyridine
CID 91204403
N-(2-pyridin-3-ylethyl)octan-2-amine
CID 60914592
N-(1-phenylethyl)-5-pyridin-3-ylpentan-2-amine
CID 70358697
(2S)-5-pyridin-3-ylpentan-2-ol
CID 10899042
N-methyl-14-pyridin-3-yltetradecan-1-amine
CID 11001217
N-methyl-6-phenyl-1-pyridin-3-ylhexan-3-amine
CID 105139816
N-(5-pyridin-3-ylpentan-2-yl)prop-2-enamide
CID 23051243
N-methyl-5-phenyl-1-pyridin-3-ylpentan-2-amine
CID 62604554
ethane;4-pyridin-3-ylbutan-1-ol
CID 177219832
4-pyridin-3-ylbutan-2-ylcarbamic acid
CID 146273639

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-pyridin-3-ylhexan-2-amine?
The IUPAC name of N-methyl-6-pyridin-3-ylhexan-2-amine (CID 18177774) is N-methyl-6-pyridin-3-ylhexan-2-amine.
What is the SMILES notation for N-methyl-6-pyridin-3-ylhexan-2-amine?
The canonical SMILES for N-methyl-6-pyridin-3-ylhexan-2-amine is CNC(C)CCCCc1cccnc1.
What is the InChIKey of N-methyl-6-pyridin-3-ylhexan-2-amine?
The InChIKey is RBULXMMRRJDMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-11(13-2)6-3-4-7-12-8-5-9-14-10-12/h5,8-11,13H,3-4,6-7H2,1-2H3.
What are the key properties of N-methyl-6-pyridin-3-ylhexan-2-amine?
N-methyl-6-pyridin-3-ylhexan-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-pyridin-3-ylhexan-2-amine is sourced from PubChem (CID 18177774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).