5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol

C15H30N2O — CID 106122125

IUPAC5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol
SMILESCC(O)CCCNC1CCCCC1C1CCCN1
InChIInChI=1S/C15H30N2O/c1-12(18)6-4-10-16-14-8-3-2-7-13(14)15-9-5-11-17-15/h12-18H,2-11H2,1H3
InChIKeyZUWCFIAHLCXGMW-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.05
Rot. Bonds6

About 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol

5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol (PubChem CID 106122125) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol.

Molecular Properties

Compound Name5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol
PubChem CID106122125
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol
SMILESCC(O)CCCNC1CCCCC1C1CCCN1
InChIInChI=1S/C15H30N2O/c1-12(18)6-4-10-16-14-8-3-2-7-13(14)15-9-5-11-17-15/h12-18H,2-11H2,1H3
InChIKeyZUWCFIAHLCXGMW-UHFFFAOYSA-N
XLogP2.05
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methylsulfanylpropyl)-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79549363
2-piperidin-2-yl-N-(3-propan-2-yloxypropyl)cyclohexan-1-amine
CID 79552730
3-[(2-piperidin-2-ylcyclopentyl)amino]propan-1-ol
CID 79544914
2-piperidin-2-yl-N-(4-propan-2-yloxybutyl)cyclohexan-1-amine
CID 106007566
2-methyl-3-[(2-pyrrolidin-2-ylcyclohexyl)amino]propan-1-ol
CID 79549663
N-hexyl-2-piperidin-2-ylcyclopentan-1-amine
CID 79545809
N'-(2-pyrrolidin-2-ylcyclopentyl)butane-1,4-diamine
CID 79543435
N-(2-propan-2-yloxyethyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 104759328
N-(2-methylpropyl)-2-piperidin-2-ylcyclopentan-1-amine
CID 79544832
N-[3-[(2-piperidin-2-ylcyclopentyl)amino]propyl]methanesulfonamide
CID 106332903
trans-(1S,2S)-2-(4-hydroxypentylamino)cyclohexan-1-ol
CID 106131373
N',N'-diethyl-N-(2-piperidin-2-ylcyclohexyl)propane-1,3-diamine
CID 79537332

Frequently Asked Questions

What is the IUPAC name of 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol?
The IUPAC name of 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol (CID 106122125) is 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol.
What is the SMILES notation for 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol?
The canonical SMILES for 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol is CC(O)CCCNC1CCCCC1C1CCCN1.
What is the InChIKey of 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol?
The InChIKey is ZUWCFIAHLCXGMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12(18)6-4-10-16-14-8-3-2-7-13(14)15-9-5-11-17-15/h12-18H,2-11H2,1H3.
What are the key properties of 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol?
5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol has a molecular weight of 254.42 g/mol, XLogP of 2.05, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-pyrrolidin-2-ylcyclohexyl)amino]pentan-2-ol is sourced from PubChem (CID 106122125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).