N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine

C17H28N2O — CID 105026181

IUPACN-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine
SMILESCCCNC(c1cncc(OC)c1)C1(CC)CCCC1
InChIInChI=1S/C17H28N2O/c1-4-10-19-16(17(5-2)8-6-7-9-17)14-11-15(20-3)13-18-12-14/h11-13,16,19H,4-10H2,1-3H3
InChIKeyBLUSQFAQJATLEB-UHFFFAOYSA-N
MW276.42 g/mol
LogP4.10
Rot. Bonds7

About N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine

N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine (PubChem CID 105026181) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine
PubChem CID105026181
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine
SMILESCCCNC(c1cncc(OC)c1)C1(CC)CCCC1
InChIInChI=1S/C17H28N2O/c1-4-10-19-16(17(5-2)8-6-7-9-17)14-11-15(20-3)13-18-12-14/h11-13,16,19H,4-10H2,1-3H3
InChIKeyBLUSQFAQJATLEB-UHFFFAOYSA-N
XLogP4.10
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine with MolForge

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Related Compounds

N-[(1-methoxycyclobutyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]propan-1-amine
CID 116714896
N-[1-(5-methoxy-3-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]propan-1-amine
CID 105175348
N-[(5-fluoro-3-pyridinyl)-[1-(2-methylpropyl)cyclopentyl]methyl]propan-1-amine
CID 115804175
1-(5-methoxy-3-pyridinyl)-2,2-dimethyl-N-propylbutan-1-amine
CID 105026226
N-[(1-ethylcyclopentyl)-(1-ethylpyrazol-4-yl)methyl]propan-1-amine
CID 115816322
1-(5-methoxy-3-pyridinyl)-N-propylhexan-1-amine
CID 105026088
1-(5-methoxy-3-pyridinyl)-3,4,4-trimethyl-N-propylpentan-1-amine
CID 105026112
3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine
CID 105025931
2-ethoxy-1-(5-methoxy-3-pyridinyl)-3,3-dimethyl-N-propylbutan-1-amine
CID 116726056
2-ethoxy-1-(5-methoxy-3-pyridinyl)-3-methyl-N-propylbutan-1-amine
CID 116721748
N-[(5-methoxy-3-pyridinyl)-(5-methylfuran-3-yl)methyl]propan-1-amine
CID 105025942
N-[(5-methoxy-3-pyridinyl)-(4-methyl-3-pyridinyl)methyl]propan-1-amine
CID 114878523

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine?
The IUPAC name of N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine (CID 105026181) is N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine?
The canonical SMILES for N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine is CCCNC(c1cncc(OC)c1)C1(CC)CCCC1.
What is the InChIKey of N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine?
The InChIKey is BLUSQFAQJATLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-10-19-16(17(5-2)8-6-7-9-17)14-11-15(20-3)13-18-12-14/h11-13,16,19H,4-10H2,1-3H3.
What are the key properties of N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine?
N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine has a molecular weight of 276.42 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine is sourced from PubChem (CID 105026181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).