4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol

C15H32N2O — CID 103784472

IUPAC4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol
SMILESCC(C)N1CCC(NCC(O)CC(C)(C)C)CC1
InChIInChI=1S/C15H32N2O/c1-12(2)17-8-6-13(7-9-17)16-11-14(18)10-15(3,4)5/h12-14,16,18H,6-11H2,1-5H3
InChIKeyPLFCOCPMWILJMK-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds5

About 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol

4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol (PubChem CID 103784472) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol
PubChem CID103784472
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol
SMILESCC(C)N1CCC(NCC(O)CC(C)(C)C)CC1
InChIInChI=1S/C15H32N2O/c1-12(2)17-8-6-13(7-9-17)16-11-14(18)10-15(3,4)5/h12-14,16,18H,6-11H2,1-5H3
InChIKeyPLFCOCPMWILJMK-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-dimethyl-1-[(1-methylpiperidin-4-yl)amino]pentan-2-ol
CID 91662929
(2R)-1-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 93033302
4,4-dimethyl-1-[(1-methylazepan-4-yl)amino]pentan-2-ol
CID 103859816
1-(cyclooctylamino)-4,4-dimethylpentan-2-ol
CID 103784422
4-methyl-1-[(1-propan-2-ylazepan-4-yl)amino]pentan-2-ol
CID 107151725
1,1-difluoro-3-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 103788055
N-(3,3-dimethylbutyl)-1-propan-2-ylpiperidin-4-amine
CID 60693742
N-ethyl-1-propan-2-ylpiperidin-4-amine
CID 24692919
tert-butyl N-[3-methyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]butan-2-yl]carbamate
CID 103783956
1-[(3-aminocyclopentyl)amino]-4,4-dimethylpentan-2-ol
CID 107151493
2-methyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]butan-2-ol
CID 65107935
2-methyl-1-[(1-propan-2-ylazepan-4-yl)amino]propan-2-ol
CID 65103038

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol?
The IUPAC name of 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol (CID 103784472) is 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol.
What is the SMILES notation for 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol?
The canonical SMILES for 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol is CC(C)N1CCC(NCC(O)CC(C)(C)C)CC1.
What is the InChIKey of 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol?
The InChIKey is PLFCOCPMWILJMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)17-8-6-13(7-9-17)16-11-14(18)10-15(3,4)5/h12-14,16,18H,6-11H2,1-5H3.
What are the key properties of 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol?
4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]pentan-2-ol is sourced from PubChem (CID 103784472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).