1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine

C16H26N2O — CID 79168840

IUPAC1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine
SMILESCCC(N)Cc1nc(C)ccc1OCC1CCCC1
InChIInChI=1S/C16H26N2O/c1-3-14(17)10-15-16(9-8-12(2)18-15)19-11-13-6-4-5-7-13/h8-9,13-14H,3-7,10-11,17H2,1-2H3
InChIKeyLNAIGTDDEJHNEJ-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.24
Rot. Bonds6

About 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine

1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine (PubChem CID 79168840) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine.

Molecular Properties

Compound Name1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine
PubChem CID79168840
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine
SMILESCCC(N)Cc1nc(C)ccc1OCC1CCCC1
InChIInChI=1S/C16H26N2O/c1-3-14(17)10-15-16(9-8-12(2)18-15)19-11-13-6-4-5-7-13/h8-9,13-14H,3-7,10-11,17H2,1-2H3
InChIKeyLNAIGTDDEJHNEJ-UHFFFAOYSA-N
XLogP3.24
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]ethanamine
CID 79169642
1-(6-methyl-3-octoxy-2-pyridinyl)butan-2-amine
CID 79164912
1-[6-methyl-3-[(4-methylmorpholin-2-yl)methoxy]-2-pyridinyl]butan-2-amine
CID 79171631
1-[3-(3,4-dimethylcyclohexyl)oxy-6-methyl-2-pyridinyl]butan-2-amine
CID 79165140
1-[3-(3,5-dimethylcyclohexyl)oxy-6-methyl-2-pyridinyl]butan-2-amine
CID 79164939
1-[3-(2-ethylhexoxy)-6-methyl-2-pyridinyl]butan-2-amine
CID 79165128
1-[4-(cyclopropylmethoxy)-2,3-dimethylphenyl]butan-2-amine;hydrochloride
CID 170890247
1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]butan-2-amine
CID 79164930
1-[2-chloro-6-(cyclohexylmethoxy)phenyl]butan-2-amine
CID 114322036
1-[3-(2-imidazol-1-ylethoxy)-6-methyl-2-pyridinyl]butan-2-amine
CID 79169011
1-[3-[(1-ethylpyrazol-4-yl)methoxy]-6-methyl-2-pyridinyl]butan-2-amine
CID 79164910
1-[4-(cyclobutylmethoxy)phenyl]butan-2-amine
CID 65459298

Frequently Asked Questions

What is the IUPAC name of 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine?
The IUPAC name of 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine (CID 79168840) is 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine.
What is the SMILES notation for 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine?
The canonical SMILES for 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine is CCC(N)Cc1nc(C)ccc1OCC1CCCC1.
What is the InChIKey of 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine?
The InChIKey is LNAIGTDDEJHNEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-14(17)10-15-16(9-8-12(2)18-15)19-11-13-6-4-5-7-13/h8-9,13-14H,3-7,10-11,17H2,1-2H3.
What are the key properties of 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine?
1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(cyclopentylmethoxy)-6-methyl-2-pyridinyl]butan-2-amine is sourced from PubChem (CID 79168840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).