N-hex-5-en-2-yloxan-4-amine

C11H21NO — CID 104581845

IUPACN-hex-5-en-2-yloxan-4-amine
SMILESC=CCCC(C)NC1CCOCC1
InChIInChI=1S/C11H21NO/c1-3-4-5-10(2)12-11-6-8-13-9-7-11/h3,10-12H,1,4-9H2,2H3
InChIKeyQDVWFARICFKWJF-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.11
Rot. Bonds5

About N-hex-5-en-2-yloxan-4-amine

N-hex-5-en-2-yloxan-4-amine (PubChem CID 104581845) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-hex-5-en-2-yloxan-4-amine.

Molecular Properties

Compound NameN-hex-5-en-2-yloxan-4-amine
PubChem CID104581845
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-hex-5-en-2-yloxan-4-amine
SMILESC=CCCC(C)NC1CCOCC1
InChIInChI=1S/C11H21NO/c1-3-4-5-10(2)12-11-6-8-13-9-7-11/h3,10-12H,1,4-9H2,2H3
InChIKeyQDVWFARICFKWJF-UHFFFAOYSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-hex-5-en-2-ylcyclopropanamine
CID 104581323
N-hex-5-en-2-yloxetan-3-amine
CID 104655767
N-hex-5-en-2-yl-4-methylcyclohexan-1-amine
CID 104581515
4-(hex-5-en-2-ylamino)cyclohexan-1-ol
CID 75525485
N-hex-5-en-2-yl-1-methylpiperidin-4-amine
CID 75525498
N-pent-4-en-2-yloxepan-4-amine
CID 115890446
N-hex-5-en-2-ylcyclopent-3-en-1-amine
CID 104582994
N-(1-cyclopropylpropan-2-yl)oxan-4-amine
CID 63989117
(3S)-N-[(2R)-hex-5-en-2-yl]-1-methylpyrrolidin-3-amine
CID 97358828
2-cyclopropyl-N-hex-5-en-2-yloxolan-3-amine
CID 104583626
(3S)-N-[(2S)-hex-5-en-2-yl]-1,1-dioxothiolan-3-amine
CID 97358805
N-[1-(oxan-4-yl)propan-2-yl]cyclopentanamine
CID 115704973

Frequently Asked Questions

What is the IUPAC name of N-hex-5-en-2-yloxan-4-amine?
The IUPAC name of N-hex-5-en-2-yloxan-4-amine (CID 104581845) is N-hex-5-en-2-yloxan-4-amine.
What is the SMILES notation for N-hex-5-en-2-yloxan-4-amine?
The canonical SMILES for N-hex-5-en-2-yloxan-4-amine is C=CCCC(C)NC1CCOCC1.
What is the InChIKey of N-hex-5-en-2-yloxan-4-amine?
The InChIKey is QDVWFARICFKWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-4-5-10(2)12-11-6-8-13-9-7-11/h3,10-12H,1,4-9H2,2H3.
What are the key properties of N-hex-5-en-2-yloxan-4-amine?
N-hex-5-en-2-yloxan-4-amine has a molecular weight of 183.29 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-5-en-2-yloxan-4-amine is sourced from PubChem (CID 104581845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).