N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine

C15H24N2O — CID 62298054

IUPACN-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine
SMILESCCNCc1ccc(OC2CCCCCC2)nc1
InChIInChI=1S/C15H24N2O/c1-2-16-11-13-9-10-15(17-12-13)18-14-7-5-3-4-6-8-14/h9-10,12,14,16H,2-8,11H2,1H3
InChIKeyXBAFPMLRSODNHW-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.29
Rot. Bonds5

About N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine

N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine (PubChem CID 62298054) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine
PubChem CID62298054
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine
SMILESCCNCc1ccc(OC2CCCCCC2)nc1
InChIInChI=1S/C15H24N2O/c1-2-16-11-13-9-10-15(17-12-13)18-14-7-5-3-4-6-8-14/h9-10,12,14,16H,2-8,11H2,1H3
InChIKeyXBAFPMLRSODNHW-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

1-(6-cyclopentyloxy-3-pyridinyl)-N-(1H-pyrazol-4-ylmethyl)methanamine
CID 166187417
3-[[(6-cyclopentyloxy-3-pyridinyl)methylamino]methyl]benzoic acid
CID 122030447
1-[(6-cyclopentyloxy-3-pyridinyl)methyl]-3-(2-methoxy-2-methylpropyl)-2-methylguanidine;hydroiodide
CID 111607886
N-[(6-cyclohexyloxy-3-pyridinyl)methyl]-1-[(6S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methanamine
CID 136905287
N-[(6-cyclopentyloxy-3-pyridinyl)methyl]-3,4-diethoxybenzamide
CID 60520618
N-[(6-cyclohexyloxy-3-pyridinyl)methyl]-1-pyrazin-2-ylethanamine
CID 75427846
2-[(6-cyclopentyloxy-3-pyridinyl)methyl]-1-cyclopropyl-3-ethylguanidine
CID 110987722
1-[(6-cyclopentyloxy-3-pyridinyl)methyl]-3-ethyl-2-(thiophen-3-ylmethyl)guanidine
CID 111940921
2-[(6-cyclohexyloxy-3-pyridinyl)methyl]-1-ethyl-3-[(5-methyl-1,3-thiazol-2-yl)methyl]guanidine
CID 111524378
2-cyclohexyloxy-5-methoxypyridine
CID 170010378
N-[(6-cyclopentyloxy-3-pyridinyl)methyl]-3-methyl-1,2,4-thiadiazol-5-amine
CID 133318360
CID 51136058
CID 51136058

Frequently Asked Questions

What is the IUPAC name of N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine (CID 62298054) is N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine is CCNCc1ccc(OC2CCCCCC2)nc1.
What is the InChIKey of N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine?
The InChIKey is XBAFPMLRSODNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-16-11-13-9-10-15(17-12-13)18-14-7-5-3-4-6-8-14/h9-10,12,14,16H,2-8,11H2,1H3.
What are the key properties of N-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine?
N-[(6-cycloheptyloxy-3-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-[(6-cycloheptyloxy-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 62298054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).