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

C17H28N2O — CID 106632567

IUPAC1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol
SMILESCCN(CC1CCCCN1)CC(C)(O)c1ccccc1
InChIInChI=1S/C17H28N2O/c1-3-19(13-16-11-7-8-12-18-16)14-17(2,20)15-9-5-4-6-10-15/h4-6,9-10,16,18,20H,3,7-8,11-14H2,1-2H3
InChIKeyZHPVDZPGOZRPPN-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.36
Rot. Bonds6

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

1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol (PubChem CID 106632567) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol.

Molecular Properties

Compound Name1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol
PubChem CID106632567
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol
SMILESCCN(CC1CCCCN1)CC(C)(O)c1ccccc1
InChIInChI=1S/C17H28N2O/c1-3-19(13-16-11-7-8-12-18-16)14-17(2,20)15-9-5-4-6-10-15/h4-6,9-10,16,18,20H,3,7-8,11-14H2,1-2H3
InChIKeyZHPVDZPGOZRPPN-UHFFFAOYSA-N
XLogP2.36
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[cyclopropylmethyl(ethyl)amino]-2-phenylpropan-2-ol
CID 63956044
N-benzyl-N-(piperidin-2-ylmethyl)ethanamine;dihydrochloride
CID 56831759
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
N-(azepan-2-ylmethyl)-N-ethylethanamine
CID 4715268
1,1-diphenyl-2-[(2R)-pyrrolidin-2-yl]ethanol
CID 89497125
N-(piperidin-2-ylmethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 106622610
N-(azocan-2-ylmethyl)-N-ethylaniline
CID 114240324
3,3-diphenyl-1-piperidin-2-ylbutan-2-ol
CID 22237347
N-ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 4715267
N-(2,2-difluoro-2-phenylethyl)-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106632139
N-(pyrrolidin-2-ylmethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 106603566
N-(cyclopentylmethyl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106622509

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol?
The IUPAC name of 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol (CID 106632567) is 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol.
What is the SMILES notation for 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol?
The canonical SMILES for 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol is CCN(CC1CCCCN1)CC(C)(O)c1ccccc1.
What is the InChIKey of 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol?
The InChIKey is ZHPVDZPGOZRPPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-3-19(13-16-11-7-8-12-18-16)14-17(2,20)15-9-5-4-6-10-15/h4-6,9-10,16,18,20H,3,7-8,11-14H2,1-2H3.
What are the key properties of 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol?
1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol has a molecular weight of 276.42 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(piperidin-2-ylmethyl)amino]-2-phenylpropan-2-ol is sourced from PubChem (CID 106632567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).