5-[(3-methoxycyclobutyl)amino]pentan-1-ol

C10H21NO2 — CID 107316808

IUPAC5-[(3-methoxycyclobutyl)amino]pentan-1-ol
SMILESCOC1CC(NCCCCCO)C1
InChIInChI=1S/C10H21NO2/c1-13-10-7-9(8-10)11-5-3-2-4-6-12/h9-12H,2-8H2,1H3
InChIKeyJEWZTHNPUCXBMJ-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.92
Rot. Bonds7

About 5-[(3-methoxycyclobutyl)amino]pentan-1-ol

5-[(3-methoxycyclobutyl)amino]pentan-1-ol (PubChem CID 107316808) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 5-[(3-methoxycyclobutyl)amino]pentan-1-ol.

Molecular Properties

Compound Name5-[(3-methoxycyclobutyl)amino]pentan-1-ol
PubChem CID107316808
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name5-[(3-methoxycyclobutyl)amino]pentan-1-ol
SMILESCOC1CC(NCCCCCO)C1
InChIInChI=1S/C10H21NO2/c1-13-10-7-9(8-10)11-5-3-2-4-6-12/h9-12H,2-8H2,1H3
InChIKeyJEWZTHNPUCXBMJ-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-hexyl-3-methoxycyclobutan-1-amine
CID 104870767
N-hex-5-ynyl-3-methoxycyclobutan-1-amine
CID 104871898
4-[(3,5-dimethylcyclohexyl)amino]butan-1-ol
CID 64731694
3-methoxy-N-pent-4-ynylcyclobutan-1-amine
CID 104871850
4-(thietan-3-ylamino)butan-1-ol
CID 126989809
N-(3,3-dimethylbutyl)-3-methoxycyclobutan-1-amine
CID 104870848
5-[(3,4-dimethylcyclohexyl)amino]pentan-1-ol
CID 64741111
3-[[(3R,5S)-3,5-dimethylcyclohexyl]amino]propan-1-ol
CID 96732218
1-[(3-methoxycyclobutyl)amino]pentan-3-ol
CID 104871930
6-[(1-methylpiperidin-4-yl)amino]hexan-1-ol
CID 115906765
5-[(3-phenylcyclobutyl)amino]pentan-1-ol
CID 107303071
5-[(4-tert-butylcyclohexyl)amino]pentan-1-ol
CID 107302888

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methoxycyclobutyl)amino]pentan-1-ol?
The IUPAC name of 5-[(3-methoxycyclobutyl)amino]pentan-1-ol (CID 107316808) is 5-[(3-methoxycyclobutyl)amino]pentan-1-ol.
What is the SMILES notation for 5-[(3-methoxycyclobutyl)amino]pentan-1-ol?
The canonical SMILES for 5-[(3-methoxycyclobutyl)amino]pentan-1-ol is COC1CC(NCCCCCO)C1.
What is the InChIKey of 5-[(3-methoxycyclobutyl)amino]pentan-1-ol?
The InChIKey is JEWZTHNPUCXBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-13-10-7-9(8-10)11-5-3-2-4-6-12/h9-12H,2-8H2,1H3.
What are the key properties of 5-[(3-methoxycyclobutyl)amino]pentan-1-ol?
5-[(3-methoxycyclobutyl)amino]pentan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.92, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methoxycyclobutyl)amino]pentan-1-ol is sourced from PubChem (CID 107316808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).