N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine

C12H24N2O — CID 65384575

IUPACN-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine
SMILESNCC(NC1CCCC1)C1CCOCC1
InChIInChI=1S/C12H24N2O/c13-9-12(10-5-7-15-8-6-10)14-11-3-1-2-4-11/h10-12,14H,1-9,13H2
InChIKeyBUDAISMRQZGGPI-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.27
Rot. Bonds4

About N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine

N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine (PubChem CID 65384575) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine
PubChem CID65384575
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine
SMILESNCC(NC1CCCC1)C1CCOCC1
InChIInChI=1S/C12H24N2O/c13-9-12(10-5-7-15-8-6-10)14-11-3-1-2-4-11/h10-12,14H,1-9,13H2
InChIKeyBUDAISMRQZGGPI-UHFFFAOYSA-N
XLogP1.27
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 65379536
2-(cyclohexylamino)-2-(oxan-4-yl)ethanol
CID 62391437
2-(cycloheptylamino)-2-(oxolan-3-yl)ethanol
CID 61055158
2-(cycloheptylamino)-2-cyclopropylethanol
CID 61308259
2-[[2-amino-1-(oxan-4-yl)ethyl]amino]ethanol
CID 65381935
N-cyclopentyl-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82836031
N-[1-(oxan-4-yl)propan-2-yl]cyclopentanamine
CID 115704973
[1-cycloheptyl-2-(oxan-4-yl)ethyl]hydrazine
CID 105231923
N-but-3-ynyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 116641090
N-(1-cyclopropyl-2-fluoroethyl)cyclohexanamine
CID 83817487
2-(2,2-dimethylhydrazinyl)-2-(oxolan-3-yl)ethanamine
CID 83010989
2-cyclopropyl-2-(cyclopropylamino)acetonitrile;N,1-dicyclopropylethane-1,2-diamine
CID 158517031

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine?
The IUPAC name of N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine (CID 65384575) is N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine is NCC(NC1CCCC1)C1CCOCC1.
What is the InChIKey of N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine?
The InChIKey is BUDAISMRQZGGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c13-9-12(10-5-7-15-8-6-10)14-11-3-1-2-4-11/h10-12,14H,1-9,13H2.
What are the key properties of N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine?
N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine has a molecular weight of 212.34 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(oxan-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 65384575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).