N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine

C13H22N2O — CID 63985472

IUPACN-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine
SMILESCCCCC(C)NCc1cccc(OC)n1
InChIInChI=1S/C13H22N2O/c1-4-5-7-11(2)14-10-12-8-6-9-13(15-12)16-3/h6,8-9,11,14H,4-5,7,10H2,1-3H3
InChIKeyIKQBAEAPHJQVCK-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.76
Rot. Bonds7

About N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine

N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine (PubChem CID 63985472) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine.

Molecular Properties

Compound NameN-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine
PubChem CID63985472
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine
SMILESCCCCC(C)NCc1cccc(OC)n1
InChIInChI=1S/C13H22N2O/c1-4-5-7-11(2)14-10-12-8-6-9-13(15-12)16-3/h6,8-9,11,14H,4-5,7,10H2,1-3H3
InChIKeyIKQBAEAPHJQVCK-UHFFFAOYSA-N
XLogP2.76
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-methoxy-2-pyridinyl)methyl]octan-4-amine
CID 103781524
N-[(6-bromo-2-pyridinyl)methyl]hexan-2-amine
CID 112582303
6-[(6-methoxy-2-pyridinyl)methylamino]-2-methylheptanoic acid
CID 65288719
4-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]butan-2-amine
CID 63985074
(1S)-1-(2-methoxyphenyl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine
CID 81397060
N-[(6-butoxy-2-pyridinyl)methyl]propan-2-amine
CID 62291321
1-chloro-N-[(6-methoxy-2-pyridinyl)methyl]-3-methylbutan-2-amine
CID 79259192
(1S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-(2-methylphenyl)ethanamine
CID 81374235
N-[(6-pentoxy-2-pyridinyl)methyl]propan-2-amine
CID 55058638
methyl 2-[(6-methoxy-2-pyridinyl)methylamino]propanoate
CID 63986668
N-[(6-octan-2-yloxy-2-pyridinyl)methyl]propan-2-amine
CID 63489673
N-[(4-methoxyphenyl)methyl]hexan-2-amine
CID 43760039

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine?
The IUPAC name of N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine (CID 63985472) is N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine.
What is the SMILES notation for N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine?
The canonical SMILES for N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine is CCCCC(C)NCc1cccc(OC)n1.
What is the InChIKey of N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine?
The InChIKey is IKQBAEAPHJQVCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-4-5-7-11(2)14-10-12-8-6-9-13(15-12)16-3/h6,8-9,11,14H,4-5,7,10H2,1-3H3.
What are the key properties of N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine?
N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine has a molecular weight of 222.33 g/mol, XLogP of 2.76, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-2-pyridinyl)methyl]hexan-2-amine is sourced from PubChem (CID 63985472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).