N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine

C14H27NO2 — CID 103991212

IUPACN-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine
SMILESCCCC1CC(NCCOCC2CC2)CCO1
InChIInChI=1S/C14H27NO2/c1-2-3-14-10-13(6-8-17-14)15-7-9-16-11-12-4-5-12/h12-15H,2-11H2,1H3
InChIKeyOPVNMXHQSRZHKX-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.35
Rot. Bonds8

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

N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine (PubChem CID 103991212) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine
PubChem CID103991212
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine
SMILESCCCC1CC(NCCOCC2CC2)CCO1
InChIInChI=1S/C14H27NO2/c1-2-3-14-10-13(6-8-17-14)15-7-9-16-11-12-4-5-12/h12-15H,2-11H2,1H3
InChIKeyOPVNMXHQSRZHKX-UHFFFAOYSA-N
XLogP2.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.35
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-[2-(1-methylpiperidin-4-yl)ethyl]-2-propyloxan-4-amine
CID 103991149
6-[(2-propyloxan-4-yl)amino]hexan-1-ol
CID 103991516
2-[2-[(2-ethyloxan-4-yl)amino]ethoxy]acetamide
CID 106236551
N-(3-methyl-2-propan-2-ylbutyl)-2-propyloxan-4-amine
CID 102904715
N-[(2,2-dimethylcyclopropyl)methyl]-2-propyloxan-4-amine
CID 103991250
N-[2-(2-methylphenyl)ethyl]-2-propyloxan-4-amine
CID 79762409
N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine
CID 113362714
tert-butyl N-methyl-N-[2-[(2-propyloxan-4-yl)amino]ethyl]carbamate
CID 103991105
1-piperidin-1-yl-3-[(2-propyloxan-4-yl)amino]propan-1-one
CID 103991051
N-[2-(cyclopropylmethoxy)ethyl]cyclooctanamine
CID 115718328
4-methyl-1-[(2-propyloxan-4-yl)amino]pentan-2-ol
CID 103991084
N-[2-(1H-imidazol-5-yl)ethyl]-2-propyloxan-4-amine
CID 65230541

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine (CID 103991212) is N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine is CCCC1CC(NCCOCC2CC2)CCO1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine?
The InChIKey is OPVNMXHQSRZHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-3-14-10-13(6-8-17-14)15-7-9-16-11-12-4-5-12/h12-15H,2-11H2,1H3.
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine?
N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine has a molecular weight of 241.37 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine is sourced from PubChem (CID 103991212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).