1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol

C13H26N2O — CID 65212493

IUPAC1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol
SMILESNCCC1CCCN(CC2(O)CCCC2)C1
InChIInChI=1S/C13H26N2O/c14-8-5-12-4-3-9-15(10-12)11-13(16)6-1-2-7-13/h12,16H,1-11,14H2
InChIKeyMEKVXAUWWQQQLU-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.35
Rot. Bonds4

About 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol

1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol (PubChem CID 65212493) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol
PubChem CID65212493
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol
SMILESNCCC1CCCN(CC2(O)CCCC2)C1
InChIInChI=1S/C13H26N2O/c14-8-5-12-4-3-9-15(10-12)11-13(16)6-1-2-7-13/h12,16H,1-11,14H2
InChIKeyMEKVXAUWWQQQLU-UHFFFAOYSA-N
XLogP1.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[3-(aminomethyl)pyrrolidin-1-yl]methyl]cyclohexan-1-ol
CID 65213325
1-[[3-[(2-methylpropylamino)methyl]piperidin-1-yl]methyl]cyclohexan-1-ol
CID 65213827
2-[1-(2-fluoroethyl)piperidin-3-yl]ethanamine
CID 80695268
4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol
CID 63764428
1-[(1-hydroxycyclohexyl)methyl]piperidine-3-carboxylic acid
CID 65213320
2-[1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperidin-3-yl]ethanamine
CID 102899408
1-[[3-(1-aminoethyl)piperidin-1-yl]methyl]cyclohexan-1-ol
CID 65208581
1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
CID 65212460
1-[[3-(dimethylamino)piperidin-1-yl]methyl]cyclohexan-1-ol
CID 63950406
1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol
CID 63723420
1-(azetidin-1-ylmethyl)cyclohexan-1-ol
CID 84731810
1-[(3-amino-4-methylpiperidin-1-yl)methyl]cyclopentan-1-ol
CID 65212437

Frequently Asked Questions

What is the IUPAC name of 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol (CID 65212493) is 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol is NCCC1CCCN(CC2(O)CCCC2)C1.
What is the InChIKey of 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol?
The InChIKey is MEKVXAUWWQQQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c14-8-5-12-4-3-9-15(10-12)11-13(16)6-1-2-7-13/h12,16H,1-11,14H2.
What are the key properties of 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol?
1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-(2-aminoethyl)piperidin-1-yl]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65212493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).