1-(1-methoxycyclobutyl)pent-4-en-2-amine

C10H19NO — CID 103559101

IUPAC1-(1-methoxycyclobutyl)pent-4-en-2-amine
SMILESC=CCC(N)CC1(OC)CCC1
InChIInChI=1S/C10H19NO/c1-3-5-9(11)8-10(12-2)6-4-7-10/h3,9H,1,4-8,11H2,2H3
InChIKeyGGKIDABPSNJCSG-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.85
Rot. Bonds5

About 1-(1-methoxycyclobutyl)pent-4-en-2-amine

1-(1-methoxycyclobutyl)pent-4-en-2-amine (PubChem CID 103559101) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(1-methoxycyclobutyl)pent-4-en-2-amine.

Molecular Properties

Compound Name1-(1-methoxycyclobutyl)pent-4-en-2-amine
PubChem CID103559101
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(1-methoxycyclobutyl)pent-4-en-2-amine
SMILESC=CCC(N)CC1(OC)CCC1
InChIInChI=1S/C10H19NO/c1-3-5-9(11)8-10(12-2)6-4-7-10/h3,9H,1,4-8,11H2,2H3
InChIKeyGGKIDABPSNJCSG-UHFFFAOYSA-N
XLogP1.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.85
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

3-(Tert-butoxy)-2-(prop-2-en-1-yl)cyclobutan-1-amine
CID 137942225
(1R)-1-[(1S)-2-[(E)-hex-3-enyl]-2-methoxycyclopropyl]ethanamine
CID 164145309
6-Methoxy-6-methylhept-1-en-4-amine
CID 103024962
2-Methoxy-2-methylnon-8-en-4-amine
CID 103027272
2-Methoxy-2-methyloct-7-en-4-amine
CID 103027276
7-Methoxy-7-methyloct-1-en-4-amine
CID 103036043
N-ethyl-1-(1-methoxycyclobutyl)pent-4-en-2-amine
CID 103559098
1-(1-methoxycyclobutyl)-N-propylpent-4-en-2-amine
CID 103559099
1-(1-methoxycyclobutyl)-N-methylpent-4-en-2-amine
CID 103559100
N-ethyl-1-(1-methoxycyclobutyl)hept-6-en-2-amine
CID 103559402
1-(1-methoxycyclobutyl)-N-methylhept-6-en-2-amine
CID 103559403
1-(1-Methoxycyclobutyl)hept-6-en-2-amine
CID 103559404

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclobutyl)pent-4-en-2-amine?
The IUPAC name of 1-(1-methoxycyclobutyl)pent-4-en-2-amine (CID 103559101) is 1-(1-methoxycyclobutyl)pent-4-en-2-amine.
What is the SMILES notation for 1-(1-methoxycyclobutyl)pent-4-en-2-amine?
The canonical SMILES for 1-(1-methoxycyclobutyl)pent-4-en-2-amine is C=CCC(N)CC1(OC)CCC1.
What is the InChIKey of 1-(1-methoxycyclobutyl)pent-4-en-2-amine?
The InChIKey is GGKIDABPSNJCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-5-9(11)8-10(12-2)6-4-7-10/h3,9H,1,4-8,11H2,2H3.
What are the key properties of 1-(1-methoxycyclobutyl)pent-4-en-2-amine?
1-(1-methoxycyclobutyl)pent-4-en-2-amine has a molecular weight of 169.27 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclobutyl)pent-4-en-2-amine is sourced from PubChem (CID 103559101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).