N-cyclopropyl-N-methyloxan-4-amine

C9H17NO — CID 58328002

IUPACN-cyclopropyl-N-methyloxan-4-amine
SMILESCN(C1CCOCC1)C1CC1
InChIInChI=1S/C9H17NO/c1-10(8-2-3-8)9-4-6-11-7-5-9/h8-9H,2-7H2,1H3
InChIKeyWXPPFXVNSPDZIU-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.26
Rot. Bonds2

About N-cyclopropyl-N-methyloxan-4-amine

N-cyclopropyl-N-methyloxan-4-amine (PubChem CID 58328002) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-cyclopropyl-N-methyloxan-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-methyloxan-4-amine
PubChem CID58328002
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-cyclopropyl-N-methyloxan-4-amine
SMILESCN(C1CCOCC1)C1CC1
InChIInChI=1S/C9H17NO/c1-10(8-2-3-8)9-4-6-11-7-5-9/h8-9H,2-7H2,1H3
InChIKeyWXPPFXVNSPDZIU-UHFFFAOYSA-N
XLogP1.26
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyloxan-4-amine?
The IUPAC name of N-cyclopropyl-N-methyloxan-4-amine (CID 58328002) is N-cyclopropyl-N-methyloxan-4-amine.
What is the SMILES notation for N-cyclopropyl-N-methyloxan-4-amine?
The canonical SMILES for N-cyclopropyl-N-methyloxan-4-amine is CN(C1CCOCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-methyloxan-4-amine?
The InChIKey is WXPPFXVNSPDZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-10(8-2-3-8)9-4-6-11-7-5-9/h8-9H,2-7H2,1H3.
What are the key properties of N-cyclopropyl-N-methyloxan-4-amine?
N-cyclopropyl-N-methyloxan-4-amine has a molecular weight of 155.24 g/mol, XLogP of 1.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyloxan-4-amine is sourced from PubChem (CID 58328002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).