N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine

C13H22N2O — CID 103285375

IUPACN-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine
SMILESCCCC(C)COc1cc(CNC)ccn1
InChIInChI=1S/C13H22N2O/c1-4-5-11(2)10-16-13-8-12(9-14-3)6-7-15-13/h6-8,11,14H,4-5,9-10H2,1-3H3
InChIKeyUNEGVIAZTRBSKR-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.62
Rot. Bonds7

About N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine

N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine (PubChem CID 103285375) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine
PubChem CID103285375
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine
SMILESCCCC(C)COc1cc(CNC)ccn1
InChIInChI=1S/C13H22N2O/c1-4-5-11(2)10-16-13-8-12(9-14-3)6-7-15-13/h6-8,11,14H,4-5,9-10H2,1-3H3
InChIKeyUNEGVIAZTRBSKR-UHFFFAOYSA-N
XLogP2.62
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 ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-4-pyridinyl)-N-methylmethanamine;hydrochloride
CID 154963549
1-[2-(3,3-dimethylbutoxy)-4-pyridinyl]-N-methylmethanamine
CID 66225919
2-methyl-N-[[2-(2-methylpropoxy)-4-pyridinyl]methyl]propan-1-amine
CID 62291047
N-[(2-pentoxy-4-pyridinyl)methyl]propan-2-amine
CID 55058687
N-[[2-ethyl-6-(2-methylpentoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 103285465
N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine
CID 55058261
N-methyl-1-[2-[(6-methylcyclohex-3-en-1-yl)methoxy]-4-pyridinyl]methanamine
CID 62290414
4-(chloromethyl)-2-ethyl-6-(2-methylpentoxy)pyridine
CID 103284574
N-methyl-1-[2-(1-propan-2-ylpyrazol-4-yl)oxy-4-pyridinyl]methanamine
CID 116803068
1-[2-[(3-methoxyphenyl)methoxy]-4-pyridinyl]-N-methylmethanamine
CID 62288969
[4-(2-methylpentoxy)-2-pyridinyl]hydrazine
CID 103286520
2-[(2-methoxy-4-pyridinyl)methylamino]-N-pentan-2-ylacetamide
CID 62989363

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine (CID 103285375) is N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine is CCCC(C)COc1cc(CNC)ccn1.
What is the InChIKey of N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine?
The InChIKey is UNEGVIAZTRBSKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-4-5-11(2)10-16-13-8-12(9-14-3)6-7-15-13/h6-8,11,14H,4-5,9-10H2,1-3H3.
What are the key properties of N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine?
N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine has a molecular weight of 222.33 g/mol, XLogP of 2.62, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylpentoxy)-4-pyridinyl]methanamine is sourced from PubChem (CID 103285375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).