1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol

C13H28N2O — CID 62260870

IUPAC1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol
SMILESCCCC(C)(CNC)CN1CCCC(O)C1
InChIInChI=1S/C13H28N2O/c1-4-7-13(2,10-14-3)11-15-8-5-6-12(16)9-15/h12,14,16H,4-11H2,1-3H3
InChIKeyHISPBPBMXNWXJX-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.47
Rot. Bonds6

About 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol

1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol (PubChem CID 62260870) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol
PubChem CID62260870
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol
SMILESCCCC(C)(CNC)CN1CCCC(O)C1
InChIInChI=1S/C13H28N2O/c1-4-7-13(2,10-14-3)11-15-8-5-6-12(16)9-15/h12,14,16H,4-11H2,1-3H3
InChIKeyHISPBPBMXNWXJX-UHFFFAOYSA-N
XLogP1.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylmethyl)-N,2-dimethylpentan-1-amine
CID 63151603
2-[(3-ethoxypiperidin-1-yl)methyl]-N,2-dimethylpentan-1-amine
CID 62271911
2-(azepan-1-ylmethyl)-N,2-dimethylpentan-1-amine
CID 62262452
1-[2-methyl-2-(propylaminomethyl)pentyl]pyrrolidin-3-ol
CID 55131551
1-[2-(aminomethyl)-2-methylpentyl]pyrrolidin-3-ol
CID 62941187
2-[(4,4-dimethylazepan-1-yl)methyl]-N,2-dimethylpentan-1-amine
CID 65281633
1-(2-ethyl-2-hydroxybutyl)piperidin-3-ol
CID 115919280
2-(3-azaspiro[5.5]undecan-3-ylmethyl)-N,2-dimethylpentan-1-amine
CID 63494161
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-methyl-N-propan-2-ylpentan-1-amine
CID 79945461
N-[2-(azocan-1-ylmethyl)-2-methylpentyl]cyclopropanamine
CID 62261563
2-[(4,4-diethylpiperidin-1-yl)methyl]-N,2-dimethylpentan-1-amine
CID 63495294
(3S)-1-(2-methylpentan-2-yl)piperidin-3-ol
CID 130272331

Frequently Asked Questions

What is the IUPAC name of 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol?
The IUPAC name of 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol (CID 62260870) is 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol.
What is the SMILES notation for 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol?
The canonical SMILES for 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol is CCCC(C)(CNC)CN1CCCC(O)C1.
What is the InChIKey of 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol?
The InChIKey is HISPBPBMXNWXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-7-13(2,10-14-3)11-15-8-5-6-12(16)9-15/h12,14,16H,4-11H2,1-3H3.
What are the key properties of 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol?
1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol has a molecular weight of 228.38 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methyl-2-(methylaminomethyl)pentyl]piperidin-3-ol is sourced from PubChem (CID 62260870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).