5-(methylamino)pentan-1-ol;hydrochloride

C6H16ClNO — CID 14448456

IUPAC5-(methylamino)pentan-1-ol;hydrochloride
SMILESCNCCCCCO.Cl
InChIInChI=1S/C6H15NO.ClH/c1-7-5-3-2-4-6-8;/h7-8H,2-6H2,1H3;1H
InChIKeyYGDYSBCJMOFIAY-UHFFFAOYSA-N
MW153.65 g/mol
LogP0.79
Rot. Bonds5

About 5-(methylamino)pentan-1-ol;hydrochloride

5-(methylamino)pentan-1-ol;hydrochloride (PubChem CID 14448456) has the molecular formula C6H16ClNO and a molecular weight of 153.65 g/mol. Its IUPAC name is 5-(methylamino)pentan-1-ol;hydrochloride.

Molecular Properties

Compound Name5-(methylamino)pentan-1-ol;hydrochloride
PubChem CID14448456
Molecular FormulaC6H16ClNO
Molecular Weight153.65 g/mol
Exact Mass153.09
IUPAC Name5-(methylamino)pentan-1-ol;hydrochloride
SMILESCNCCCCCO.Cl
InChIInChI=1S/C6H15NO.ClH/c1-7-5-3-2-4-6-8;/h7-8H,2-6H2,1H3;1H
InChIKeyYGDYSBCJMOFIAY-UHFFFAOYSA-N
XLogP0.79
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.65
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-(Isopropylamino)pentanol
CID 414092
6-(Methylamino)hexan-1-ol
CID 10942457
5-(Methylamino)pentane-1,2-diol hydrochloride
CID 165590519
5-(Methylamino)pentan-1-ol
CID 11007875
3,3-Difluoro-5-(methylamino)pentan-1-ol
CID 134297406
3,3-Difluoro-5-(methylamino)pentan-1-ol;ethane
CID 142295329
3,3-Difluoro-5-(methylamino)pentan-1-ol;ethane;molecular hydrogen
CID 142390458
(5-Methoxypentyl)(methyl)amine
CID 300966
5-(5-Hydroxypentylamino)pentan-1-ol
CID 12664433
5-(3-Fluoropropylamino)pentan-1-ol
CID 107317265
5-(2-Fluoroethylamino)pentan-1-ol
CID 107317523
5-(Butan-2-ylamino)pentan-1-ol
CID 245050

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)pentan-1-ol;hydrochloride?
The IUPAC name of 5-(methylamino)pentan-1-ol;hydrochloride (CID 14448456) is 5-(methylamino)pentan-1-ol;hydrochloride.
What is the SMILES notation for 5-(methylamino)pentan-1-ol;hydrochloride?
The canonical SMILES for 5-(methylamino)pentan-1-ol;hydrochloride is CNCCCCCO.Cl.
What is the InChIKey of 5-(methylamino)pentan-1-ol;hydrochloride?
The InChIKey is YGDYSBCJMOFIAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO.ClH/c1-7-5-3-2-4-6-8;/h7-8H,2-6H2,1H3;1H.
What are the key properties of 5-(methylamino)pentan-1-ol;hydrochloride?
5-(methylamino)pentan-1-ol;hydrochloride has a molecular weight of 153.65 g/mol, XLogP of 0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)pentan-1-ol;hydrochloride is sourced from PubChem (CID 14448456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).