N-cyclopentyl-N,3-dimethyloxan-4-amine

C12H23NO — CID 58654141

IUPACN-cyclopentyl-N,3-dimethyloxan-4-amine
SMILESCC1COCCC1N(C)C1CCCC1
InChIInChI=1S/C12H23NO/c1-10-9-14-8-7-12(10)13(2)11-5-3-4-6-11/h10-12H,3-9H2,1-2H3
InChIKeyJQNBXNXTLVKJRA-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.29
Rot. Bonds2

About N-cyclopentyl-N,3-dimethyloxan-4-amine

N-cyclopentyl-N,3-dimethyloxan-4-amine (PubChem CID 58654141) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is N-cyclopentyl-N,3-dimethyloxan-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-N,3-dimethyloxan-4-amine
PubChem CID58654141
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC NameN-cyclopentyl-N,3-dimethyloxan-4-amine
SMILESCC1COCCC1N(C)C1CCCC1
InChIInChI=1S/C12H23NO/c1-10-9-14-8-7-12(10)13(2)11-5-3-4-6-11/h10-12H,3-9H2,1-2H3
InChIKeyJQNBXNXTLVKJRA-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N,3-dimethyloxan-4-amine?
The IUPAC name of N-cyclopentyl-N,3-dimethyloxan-4-amine (CID 58654141) is N-cyclopentyl-N,3-dimethyloxan-4-amine.
What is the SMILES notation for N-cyclopentyl-N,3-dimethyloxan-4-amine?
The canonical SMILES for N-cyclopentyl-N,3-dimethyloxan-4-amine is CC1COCCC1N(C)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N,3-dimethyloxan-4-amine?
The InChIKey is JQNBXNXTLVKJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-10-9-14-8-7-12(10)13(2)11-5-3-4-6-11/h10-12H,3-9H2,1-2H3.
What are the key properties of N-cyclopentyl-N,3-dimethyloxan-4-amine?
N-cyclopentyl-N,3-dimethyloxan-4-amine has a molecular weight of 197.32 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N,3-dimethyloxan-4-amine is sourced from PubChem (CID 58654141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).