N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine

C15H24N2O — CID 62297885

IUPACN-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine
SMILESCCNCc1cc(OC2CCCCCC2)ccn1
InChIInChI=1S/C15H24N2O/c1-2-16-12-13-11-15(9-10-17-13)18-14-7-5-3-4-6-8-14/h9-11,14,16H,2-8,12H2,1H3
InChIKeyFXMXQQPECYYYCZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.29
Rot. Bonds5

About N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine

N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine (PubChem CID 62297885) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine
PubChem CID62297885
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine
SMILESCCNCc1cc(OC2CCCCCC2)ccn1
InChIInChI=1S/C15H24N2O/c1-2-16-12-13-11-15(9-10-17-13)18-14-7-5-3-4-6-8-14/h9-11,14,16H,2-8,12H2,1H3
InChIKeyFXMXQQPECYYYCZ-UHFFFAOYSA-N
XLogP3.29
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(oxolan-3-yloxy)-2-pyridinyl]methyl]ethanamine
CID 63558303
(4-cyclopentyloxy-2-pyridinyl)methanol
CID 61258192
N-[[4-(3,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]propan-1-amine
CID 64745207
2-(4-cyclobutyloxy-2-pyridinyl)acetic acid
CID 118627309
N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine
CID 62288585
N-[(4-prop-2-enoxy-2-pyridinyl)methyl]ethanamine
CID 62288081
N-[[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-2-pyridinyl]methyl]ethanamine
CID 62321397
4-cyclobutyloxy-2-methylpyridine
CID 70661228
N-[[5-(3-ethylcyclohexyl)oxy-2-pyridinyl]methyl]ethanamine
CID 79775454
N-[[4-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 64730619
4-cyclohexyloxypyridine-2-carboxylic acid
CID 43142909
N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine
CID 62298054

Frequently Asked Questions

What is the IUPAC name of N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine (CID 62297885) is N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine is CCNCc1cc(OC2CCCCCC2)ccn1.
What is the InChIKey of N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine?
The InChIKey is FXMXQQPECYYYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-16-12-13-11-15(9-10-17-13)18-14-7-5-3-4-6-8-14/h9-11,14,16H,2-8,12H2,1H3.
What are the key properties of N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine?
N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine has a molecular weight of 248.37 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cycloheptyloxy-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 62297885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).