3-amino-1-(1-methoxycyclopentyl)propan-1-ol

C9H19NO2 — CID 165445409

IUPAC3-amino-1-(1-methoxycyclopentyl)propan-1-ol
SMILESCOC1(C(O)CCN)CCCC1
InChIInChI=1S/C9H19NO2/c1-12-9(5-2-3-6-9)8(11)4-7-10/h8,11H,2-7,10H2,1H3
InChIKeyITCHEKSQKCOSOQ-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.66
Rot. Bonds4

About 3-amino-1-(1-methoxycyclopentyl)propan-1-ol

3-amino-1-(1-methoxycyclopentyl)propan-1-ol (PubChem CID 165445409) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-amino-1-(1-methoxycyclopentyl)propan-1-ol.

Molecular Properties

Compound Name3-amino-1-(1-methoxycyclopentyl)propan-1-ol
PubChem CID165445409
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-amino-1-(1-methoxycyclopentyl)propan-1-ol
SMILESCOC1(C(O)CCN)CCCC1
InChIInChI=1S/C9H19NO2/c1-12-9(5-2-3-6-9)8(11)4-7-10/h8,11H,2-7,10H2,1H3
InChIKeyITCHEKSQKCOSOQ-UHFFFAOYSA-N
XLogP0.66
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methoxycyclopentyl)nonan-1-ol
CID 113432696
2-methoxy-1-(1-methoxycyclopentyl)ethanol
CID 104610524
1-(1-methoxycyclopentyl)hex-5-en-1-ol
CID 104610355
4,4,4-trifluoro-1-(1-methoxycyclobutyl)butan-1-ol
CID 116710452
1-(1-methoxycycloheptyl)hex-5-en-1-ol
CID 116756031
4-methoxy-1-(1-methoxycycloheptyl)-4-methylpentan-1-ol
CID 103035594
1-(1-methoxycyclopentyl)-3-methylbut-3-en-1-ol
CID 104610434
1-(1-methoxycyclobutyl)hex-5-en-1-ol
CID 116710636
1-(1-methoxycycloheptyl)-3-phenylpropan-1-ol
CID 116755787
2-cyclopropyl-1-(1-methoxycycloheptyl)ethanol
CID 116755946
2-(4-fluorophenyl)-1-(1-methoxycyclopentyl)ethanol
CID 104610295
2-(3,4-difluorophenyl)-1-(1-methoxycycloheptyl)ethanol
CID 116755817

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(1-methoxycyclopentyl)propan-1-ol?
The IUPAC name of 3-amino-1-(1-methoxycyclopentyl)propan-1-ol (CID 165445409) is 3-amino-1-(1-methoxycyclopentyl)propan-1-ol.
What is the SMILES notation for 3-amino-1-(1-methoxycyclopentyl)propan-1-ol?
The canonical SMILES for 3-amino-1-(1-methoxycyclopentyl)propan-1-ol is COC1(C(O)CCN)CCCC1.
What is the InChIKey of 3-amino-1-(1-methoxycyclopentyl)propan-1-ol?
The InChIKey is ITCHEKSQKCOSOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-12-9(5-2-3-6-9)8(11)4-7-10/h8,11H,2-7,10H2,1H3.
What are the key properties of 3-amino-1-(1-methoxycyclopentyl)propan-1-ol?
3-amino-1-(1-methoxycyclopentyl)propan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(1-methoxycyclopentyl)propan-1-ol is sourced from PubChem (CID 165445409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).