(E)-5-pentoxypent-3-en-2-amine

C10H21NO — CID 176561255

IUPAC(E)-5-pentoxypent-3-en-2-amine
SMILESCCCCCOC/C=C/C(C)N
InChIInChI=1S/C10H21NO/c1-3-4-5-8-12-9-6-7-10(2)11/h6-7,10H,3-5,8-9,11H2,1-2H3/b7-6+
InChIKeyAGMOUYWEVDGCLG-VOTSOKGWSA-N
MW171.28 g/mol
LogP2.10
Rot. Bonds7

About (E)-5-pentoxypent-3-en-2-amine

(E)-5-pentoxypent-3-en-2-amine (PubChem CID 176561255) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (E)-5-pentoxypent-3-en-2-amine.

Molecular Properties

Compound Name(E)-5-pentoxypent-3-en-2-amine
PubChem CID176561255
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(E)-5-pentoxypent-3-en-2-amine
SMILESCCCCCOC/C=C/C(C)N
InChIInChI=1S/C10H21NO/c1-3-4-5-8-12-9-6-7-10(2)11/h6-7,10H,3-5,8-9,11H2,1-2H3/b7-6+
InChIKeyAGMOUYWEVDGCLG-VOTSOKGWSA-N
XLogP2.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-5-ethoxy-1-fluoropent-3-en-2-amine
CID 20466260
1-Fluoro-2-amino-5-ethoxy-3-pentene
CID 54052969
(Z)-4-methoxyhept-2-en-1-amine
CID 89073845
(Z,2R)-5-butoxypent-3-en-2-amine
CID 117828191
(E,2R)-5-ethoxypent-3-en-2-amine
CID 129160654
ethane;(Z)-6-methoxyhex-4-en-3-amine;(Z)-pent-3-en-2-amine
CID 144182306
(Z)-6-(2-methylpropoxy)hex-4-en-2-amine
CID 169905907
(E)-5-(2-methylpentan-3-yloxy)pent-3-en-2-amine
CID 174331391
4-Pentoxybut-2-en-1-amine
CID 77110479
5-Propoxypent-3-en-1-amine
CID 79591802
4-(Oxolan-2-yl)but-3-en-2-amine
CID 103091504
(E)-4-(5-methyloxolan-2-yl)but-3-en-2-amine
CID 103091628

Frequently Asked Questions

What is the IUPAC name of (E)-5-pentoxypent-3-en-2-amine?
The IUPAC name of (E)-5-pentoxypent-3-en-2-amine (CID 176561255) is (E)-5-pentoxypent-3-en-2-amine.
What is the SMILES notation for (E)-5-pentoxypent-3-en-2-amine?
The canonical SMILES for (E)-5-pentoxypent-3-en-2-amine is CCCCCOC/C=C/C(C)N.
What is the InChIKey of (E)-5-pentoxypent-3-en-2-amine?
The InChIKey is AGMOUYWEVDGCLG-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-4-5-8-12-9-6-7-10(2)11/h6-7,10H,3-5,8-9,11H2,1-2H3/b7-6+.
What are the key properties of (E)-5-pentoxypent-3-en-2-amine?
(E)-5-pentoxypent-3-en-2-amine has a molecular weight of 171.28 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-pentoxypent-3-en-2-amine is sourced from PubChem (CID 176561255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).