2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol

C12H26N2O — CID 63854648

IUPAC2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol
SMILESCNC(C)C1CCN(CC(C)(C)O)CC1
InChIInChI=1S/C12H26N2O/c1-10(13-4)11-5-7-14(8-6-11)9-12(2,3)15/h10-11,13,15H,5-9H2,1-4H3
InChIKeyHYGVARLWRVLNLQ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.08
Rot. Bonds4

About 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol

2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol (PubChem CID 63854648) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol
PubChem CID63854648
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol
SMILESCNC(C)C1CCN(CC(C)(C)O)CC1
InChIInChI=1S/C12H26N2O/c1-10(13-4)11-5-7-14(8-6-11)9-12(2,3)15/h10-11,13,15H,5-9H2,1-4H3
InChIKeyHYGVARLWRVLNLQ-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-2-methylpropan-2-ol
CID 63853262
1-(2-hydroxy-2-methylpropyl)piperidin-4-ol
CID 60886320
N-[1-[1-(2-amino-2-methylpropyl)piperidin-4-yl]ethyl]acetamide;hydrochloride
CID 120849636
4-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-2-methylbutan-2-ol
CID 79359785
N-cyclopropyl-3-[4-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 63854650
1-[4-[1-(methylamino)ethyl]piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 63987782
1-[1-(2-ethoxyethyl)piperidin-4-yl]-N-methylethanamine
CID 63852723
1-[1-[2,2-dimethyl-3-(methylamino)propyl]piperidin-4-yl]ethanol
CID 106837804
1-[4-(ethylamino)-3-methylpiperidin-1-yl]-2-methylpropan-2-ol
CID 114499279
N-methyl-1-[1-[3-(2,2,2-trifluoroethoxy)propyl]piperidin-4-yl]ethanamine
CID 63853081
1-cyclopropyl-N-methylethanamine;hydrochloride
CID 24649766
2-methyl-1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-2-ol
CID 106290472

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol?
The IUPAC name of 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol (CID 63854648) is 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol?
The canonical SMILES for 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol is CNC(C)C1CCN(CC(C)(C)O)CC1.
What is the InChIKey of 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol?
The InChIKey is HYGVARLWRVLNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10(13-4)11-5-7-14(8-6-11)9-12(2,3)15/h10-11,13,15H,5-9H2,1-4H3.
What are the key properties of 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol?
2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol has a molecular weight of 214.35 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[4-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 63854648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).