4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine

C14H24N2O — CID 102985121

IUPAC4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine
SMILESCCCNc1cc(COC(C)CCC)ccn1
InChIInChI=1S/C14H24N2O/c1-4-6-12(3)17-11-13-7-9-16-14(10-13)15-8-5-2/h7,9-10,12H,4-6,8,11H2,1-3H3,(H,15,16)
InChIKeyFUXMDBXWDAXJBZ-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.61
Rot. Bonds8

About 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine

4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine (PubChem CID 102985121) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine
PubChem CID102985121
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine
SMILESCCCNc1cc(COC(C)CCC)ccn1
InChIInChI=1S/C14H24N2O/c1-4-6-12(3)17-11-13-7-9-16-14(10-13)15-8-5-2/h7,9-10,12H,4-6,8,11H2,1-3H3,(H,15,16)
InChIKeyFUXMDBXWDAXJBZ-UHFFFAOYSA-N
XLogP3.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(octan-2-yloxymethyl)pyridin-2-amine
CID 55075961
4-(2-methoxyethoxymethyl)-N-propylpyridin-2-amine
CID 62466363
4-[(3,5-difluorophenoxy)methyl]-N-propylpyridin-2-amine
CID 62786008
N-propyl-4-(2,2,2-trifluoroethoxymethyl)pyridin-2-amine
CID 62463881
4-[(4-chlorophenoxy)methyl]-N-propylpyridin-2-amine
CID 62465810
4-(pentan-2-yloxymethyl)pyridine
CID 59678333
4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine
CID 112589451
4-[[methyl(3-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62465932
4-[[methyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62469698
4-(furan-2-ylmethoxymethyl)-N-propylpyridin-2-amine
CID 62464220
4-(diethylaminomethyl)-N-propylpyridin-2-amine
CID 62472000
4-[[ethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62470960

Frequently Asked Questions

What is the IUPAC name of 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine?
The IUPAC name of 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine (CID 102985121) is 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine.
What is the SMILES notation for 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine?
The canonical SMILES for 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine is CCCNc1cc(COC(C)CCC)ccn1.
What is the InChIKey of 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine?
The InChIKey is FUXMDBXWDAXJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-6-12(3)17-11-13-7-9-16-14(10-13)15-8-5-2/h7,9-10,12H,4-6,8,11H2,1-3H3,(H,15,16).
What are the key properties of 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine?
4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine has a molecular weight of 236.36 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine is sourced from PubChem (CID 102985121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).