N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine

C15H26N2O — CID 103285393

IUPACN-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCCCC(C)COc1cccc(CNC(C)C)n1
InChIInChI=1S/C15H26N2O/c1-5-7-13(4)11-18-15-9-6-8-14(17-15)10-16-12(2)3/h6,8-9,12-13,16H,5,7,10-11H2,1-4H3
InChIKeyFNNPLKIIMGYRAP-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.39
Rot. Bonds8

About N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine

N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 103285393) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine
PubChem CID103285393
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCCCC(C)COc1cccc(CNC(C)C)n1
InChIInChI=1S/C15H26N2O/c1-5-7-13(4)11-18-15-9-6-8-14(17-15)10-16-12(2)3/h6,8-9,12-13,16H,5,7,10-11H2,1-4H3
InChIKeyFNNPLKIIMGYRAP-UHFFFAOYSA-N
XLogP3.39
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(6-butoxy-2-pyridinyl)methyl]propan-2-amine
CID 62291321
N-[(6-pentoxy-2-pyridinyl)methyl]propan-2-amine
CID 55058638
N-[(6-pentan-2-yloxy-2-pyridinyl)methyl]propan-2-amine
CID 102985999
N-[[6-[2-(diethylamino)ethoxy]-2-pyridinyl]methyl]propan-2-amine
CID 55058800
2-chloro-6-(2-methylpentoxy)pyridine
CID 103283629
N-[(6-propan-2-yloxy-2-pyridinyl)methyl]propan-2-amine
CID 62290162
N-[[5-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79781493
N-[(6-but-2-enoxy-2-pyridinyl)methyl]propan-2-amine
CID 76938376
N-[[6-(4-ethoxyphenoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62296382
N-[(6-octan-2-yloxy-2-pyridinyl)methyl]propan-2-amine
CID 63489673
N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]propan-2-amine;dihydrobromide
CID 11545437
N-[[2-(2-methylpentoxy)-3-pyridinyl]methyl]propan-2-amine
CID 103285396

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine (CID 103285393) is N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine is CCCC(C)COc1cccc(CNC(C)C)n1.
What is the InChIKey of N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is FNNPLKIIMGYRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-5-7-13(4)11-18-15-9-6-8-14(17-15)10-16-12(2)3/h6,8-9,12-13,16H,5,7,10-11H2,1-4H3.
What are the key properties of N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine?
N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 103285393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).