1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol

C12H26N2O — CID 79716731

IUPAC1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol
SMILESCCN(CC1CCNCC1)CC(C)(C)O
InChIInChI=1S/C12H26N2O/c1-4-14(10-12(2,3)15)9-11-5-7-13-8-6-11/h11,13,15H,4-10H2,1-3H3
InChIKeyJUMKVNORRULSID-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.08
Rot. Bonds5

About 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol

1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol (PubChem CID 79716731) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol
PubChem CID79716731
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol
SMILESCCN(CC1CCNCC1)CC(C)(C)O
InChIInChI=1S/C12H26N2O/c1-4-14(10-12(2,3)15)9-11-5-7-13-8-6-11/h11,13,15H,4-10H2,1-3H3
InChIKeyJUMKVNORRULSID-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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

methyl 3-[ethyl(piperidin-4-ylmethyl)amino]-2-hydroxy-2-methylpropanoate
CID 113436629
N-ethyl-2,2,2-trifluoro-N-(piperidin-4-ylmethyl)ethanamine;hydrochloride
CID 119930511
1-[ethyl(piperidin-4-yl)amino]-2-methylpropan-2-ol
CID 60883814
N-ethyl-2-methylidene-N-(piperidin-4-ylmethyl)butan-1-amine
CID 79716490
2-[ethyl(piperidin-4-ylmethyl)amino]acetamide
CID 79716882
2-tert-butylsulfonyl-N-ethyl-N-(piperidin-4-ylmethyl)ethanamine
CID 106728026
5-[ethyl(piperidin-4-ylmethyl)amino]pentan-1-ol
CID 79716629
N-ethyl-N-(piperidin-4-ylmethyl)hexan-1-amine
CID 79715887
2-[2-[ethyl(piperidin-4-ylmethyl)amino]ethoxy]ethanol
CID 79717125
N,N-diethyl-4-[ethyl(piperidin-4-ylmethyl)amino]butanamide
CID 79717040
1-[ethyl(piperidin-4-ylmethyl)amino]-3-methoxypropan-2-ol
CID 79716413
2-[[cyclobutylmethyl(ethyl)amino]methyl]-2-methylpropane-1,3-diol
CID 107400471

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol (CID 79716731) is 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol is CCN(CC1CCNCC1)CC(C)(C)O.
What is the InChIKey of 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol?
The InChIKey is JUMKVNORRULSID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-14(10-12(2,3)15)9-11-5-7-13-8-6-11/h11,13,15H,4-10H2,1-3H3.
What are the key properties of 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol?
1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol has a molecular weight of 214.35 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(piperidin-4-ylmethyl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 79716731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).