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

C10H20N2O — CID 117238528

IUPACN'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine
SMILESNC(CNC1CC1)C1CCOCC1
InChIInChI=1S/C10H20N2O/c11-10(7-12-9-1-2-9)8-3-5-13-6-4-8/h8-10,12H,1-7,11H2
InChIKeyKSAIUFRMJQOSAA-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.49
Rot. Bonds4

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

N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine (PubChem CID 117238528) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine
PubChem CID117238528
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine
SMILESNC(CNC1CC1)C1CCOCC1
InChIInChI=1S/C10H20N2O/c11-10(7-12-9-1-2-9)8-3-5-13-6-4-8/h8-10,12H,1-7,11H2
InChIKeyKSAIUFRMJQOSAA-UHFFFAOYSA-N
XLogP0.49
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-ethyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 116934979
N'-cyclopropyl-1-(1-ethylpiperidin-4-yl)ethane-1,2-diamine
CID 117238537
N-[2-methyl-3-(oxan-4-yl)propyl]cyclopropanamine
CID 62530286
1-(oxan-4-yl)propane-1,3-diamine
CID 116932858
N-(2-methylpropyl)oxan-4-amine;molecular hydrogen
CID 156813143
3-methyl-1-(oxan-4-yl)butan-1-amine
CID 63935057
3,3,3-trifluoro-1-(oxan-4-yl)propan-1-amine
CID 63935479
1-cyclohexyl-2-(oxan-4-yl)ethanamine
CID 62600303
2-cyclohexyl-1-(oxan-4-yl)ethanamine
CID 65329431
N'-(oxan-4-yl)methanediamine
CID 115225482
N-(2-methylbutyl)oxan-4-amine
CID 43609665
N-[2-methyl-3-(oxan-4-yl)propyl]cyclobutanamine
CID 104586206

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine (CID 117238528) is N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine is NC(CNC1CC1)C1CCOCC1.
What is the InChIKey of N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine?
The InChIKey is KSAIUFRMJQOSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c11-10(7-12-9-1-2-9)8-3-5-13-6-4-8/h8-10,12H,1-7,11H2.
What are the key properties of N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine?
N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine has a molecular weight of 184.28 g/mol, XLogP of 0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-1-(oxan-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 117238528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).