N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine

C13H26N2O — CID 115718337

IUPACN-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine
SMILESCCN1CCC(NCCOCC2CC2)CC1
InChIInChI=1S/C13H26N2O/c1-2-15-8-5-13(6-9-15)14-7-10-16-11-12-3-4-12/h12-14H,2-11H2,1H3
InChIKeyGQYQPAODJBWWDC-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds7

About N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine

N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine (PubChem CID 115718337) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine
PubChem CID115718337
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine
SMILESCCN1CCC(NCCOCC2CC2)CC1
InChIInChI=1S/C13H26N2O/c1-2-15-8-5-13(6-9-15)14-7-10-16-11-12-3-4-12/h12-14H,2-11H2,1H3
InChIKeyGQYQPAODJBWWDC-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(cyclopropylmethoxy)propyl]-1-ethylpiperidin-4-amine
CID 28718720
N-(2-butoxyethyl)-1-ethylazepan-4-amine
CID 65073819
N-[2-(cyclopropylmethoxy)ethyl]cyclooctanamine
CID 115718328
1-ethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]azepan-4-amine
CID 65078240
N-[2-(cyclopropylmethoxy)ethyl]-4-methoxycyclohexan-1-amine
CID 104530185
1-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidin-4-amine
CID 103815473
N-[3-(cyclopropylmethoxy)propyl]-4-ethylcyclohexan-1-amine
CID 28718710
N-(cyclobutylmethyl)-1-ethylpiperidin-4-amine
CID 43298506
1-(cyclopropylmethyl)-N-(2-methoxyethyl)piperidin-4-amine
CID 115705566
N-[2-(cyclopropylmethoxy)ethyl]pyrrolidin-3-amine
CID 103882786
N-(2-ethoxyethyl)-1-(2-methylpropyl)piperidin-4-amine
CID 115709922
N-(1-ethylpiperidin-4-yl)-N'-propan-2-ylethane-1,2-diamine
CID 146359522

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine (CID 115718337) is N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine is CCN1CCC(NCCOCC2CC2)CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine?
The InChIKey is GQYQPAODJBWWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-15-8-5-13(6-9-15)14-7-10-16-11-12-3-4-12/h12-14H,2-11H2,1H3.
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine?
N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-1-ethylpiperidin-4-amine is sourced from PubChem (CID 115718337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).