N-cyclopentyloxy-1-pyridin-4-ylethanamine

C12H18N2O — CID 83229742

IUPACN-cyclopentyloxy-1-pyridin-4-ylethanamine
SMILESCC(NOC1CCCC1)c1ccncc1
InChIInChI=1S/C12H18N2O/c1-10(11-6-8-13-9-7-11)14-15-12-4-2-3-5-12/h6-10,12,14H,2-5H2,1H3
InChIKeyFPJHZGAEJQRWBO-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.61
Rot. Bonds4

About N-cyclopentyloxy-1-pyridin-4-ylethanamine

N-cyclopentyloxy-1-pyridin-4-ylethanamine (PubChem CID 83229742) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-cyclopentyloxy-1-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN-cyclopentyloxy-1-pyridin-4-ylethanamine
PubChem CID83229742
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-cyclopentyloxy-1-pyridin-4-ylethanamine
SMILESCC(NOC1CCCC1)c1ccncc1
InChIInChI=1S/C12H18N2O/c1-10(11-6-8-13-9-7-11)14-15-12-4-2-3-5-12/h6-10,12,14H,2-5H2,1H3
InChIKeyFPJHZGAEJQRWBO-UHFFFAOYSA-N
XLogP2.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyloxy-1-(4-propan-2-ylphenyl)ethanamine
CID 83229349
N-cyclopentyloxy-1-(4-iodophenyl)ethanamine
CID 83229254
N-cyclopentyloxy-1-(4-fluorophenyl)ethanamine
CID 83229680
N-cyclopentyloxy-1-(4-propan-2-yloxyphenyl)ethanamine
CID 83229574
N-[(1R)-1-pyridin-4-ylethyl]cycloheptanamine
CID 28646598
N-cyclopentyloxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 83228556
N-cyclopentyloxy-1-(3-methoxyphenyl)ethanamine
CID 83229346
N-cyclopentyloxy-1-(3-fluoro-4-methylphenyl)ethanamine
CID 83229768
1-cyclohexyloxy-3-[[(1R)-1-pyridin-4-ylethyl]amino]propan-2-ol
CID 81409866
5-[1-(cyclopentyloxyamino)ethyl]-1,3-dihydrobenzimidazol-2-one
CID 83229540
N-(2-methyl-1-pyridin-4-ylpropyl)cyclopentanamine
CID 115720159
1-(2-chlorophenyl)-N-cyclopentyloxyethanamine
CID 83228544

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-1-pyridin-4-ylethanamine?
The IUPAC name of N-cyclopentyloxy-1-pyridin-4-ylethanamine (CID 83229742) is N-cyclopentyloxy-1-pyridin-4-ylethanamine.
What is the SMILES notation for N-cyclopentyloxy-1-pyridin-4-ylethanamine?
The canonical SMILES for N-cyclopentyloxy-1-pyridin-4-ylethanamine is CC(NOC1CCCC1)c1ccncc1.
What is the InChIKey of N-cyclopentyloxy-1-pyridin-4-ylethanamine?
The InChIKey is FPJHZGAEJQRWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-10(11-6-8-13-9-7-11)14-15-12-4-2-3-5-12/h6-10,12,14H,2-5H2,1H3.
What are the key properties of N-cyclopentyloxy-1-pyridin-4-ylethanamine?
N-cyclopentyloxy-1-pyridin-4-ylethanamine has a molecular weight of 206.29 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-1-pyridin-4-ylethanamine is sourced from PubChem (CID 83229742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).