3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol

C11H20N2O — CID 106129438

IUPAC3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol
SMILESOC1CCC(CNC2=NCCCC2)C1
InChIInChI=1S/C11H20N2O/c14-10-5-4-9(7-10)8-13-11-3-1-2-6-12-11/h9-10,14H,1-8H2,(H,12,13)
InChIKeyJQAULGXXENMAEA-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.32
Rot. Bonds2

About 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol

3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol (PubChem CID 106129438) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol
PubChem CID106129438
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol
SMILESOC1CCC(CNC2=NCCCC2)C1
InChIInChI=1S/C11H20N2O/c14-10-5-4-9(7-10)8-13-11-3-1-2-6-12-11/h9-10,14H,1-8H2,(H,12,13)
InChIKeyJQAULGXXENMAEA-UHFFFAOYSA-N
XLogP1.32
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3,4-dihydro-2H-pyrrol-5-ylamino)methyl]cyclopentan-1-ol
CID 79503349
2-[(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)methyl]cyclopentan-1-ol
CID 79503444
2-[(2,3,4,5-Tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol
CID 79503445
[2-[(2,3,4,5-Tetrahydropyridin-6-ylamino)methyl]cyclopentyl]methanol
CID 79503629
1-[(3-Hydroxycyclopentyl)methyl]-2-methylguanidine
CID 103207412
3-[(3,4-dihydro-2H-pyrrol-5-ylamino)methyl]hexan-1-ol
CID 106115263
3-[(2,3,4,5-Tetrahydropyridin-6-ylamino)methyl]hexan-1-ol
CID 106115284
3-[(3,4-dihydro-2H-pyrrol-5-ylamino)methyl]cyclopentan-1-ol
CID 106129369
3-[(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)methyl]cyclopentan-1-ol
CID 106129497
3-[(3,4-dihydro-2H-pyrrol-5-ylamino)methyl]cyclohexan-1-ol
CID 106132240
4-[(3,4-dihydro-2H-pyrrol-5-ylamino)methyl]cyclohexan-1-ol
CID 106133212
4-[(2,3,4,5-Tetrahydropyridin-6-ylamino)methyl]cyclohexan-1-ol
CID 106133261

Frequently Asked Questions

What is the IUPAC name of 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol (CID 106129438) is 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol is OC1CCC(CNC2=NCCCC2)C1.
What is the InChIKey of 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is JQAULGXXENMAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c14-10-5-4-9(7-10)8-13-11-3-1-2-6-12-11/h9-10,14H,1-8H2,(H,12,13).
What are the key properties of 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol?
3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 196.29 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,3,4,5-tetrahydropyridin-6-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 106129438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).