4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine

C17H35N — CID 153330318

IUPAC4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine
SMILESCCC(C)(C)N1CCC(C(C)(C)CC(C)C)CC1
InChIInChI=1S/C17H35N/c1-8-17(6,7)18-11-9-15(10-12-18)16(4,5)13-14(2)3/h14-15H,8-13H2,1-7H3
InChIKeyHDWMZGAWWFJPJH-UHFFFAOYSA-N
MW253.47 g/mol
LogP4.96
Rot. Bonds5

About 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine

4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine (PubChem CID 153330318) has the molecular formula C17H35N and a molecular weight of 253.47 g/mol. Its IUPAC name is 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine.

Molecular Properties

Compound Name4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine
PubChem CID153330318
Molecular FormulaC17H35N
Molecular Weight253.47 g/mol
Exact Mass253.28
IUPAC Name4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine
SMILESCCC(C)(C)N1CCC(C(C)(C)CC(C)C)CC1
InChIInChI=1S/C17H35N/c1-8-17(6,7)18-11-9-15(10-12-18)16(4,5)13-14(2)3/h14-15H,8-13H2,1-7H3
InChIKeyHDWMZGAWWFJPJH-UHFFFAOYSA-N
XLogP4.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.47
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2,4-dimethylpentan-2-yl)-1-propylpiperidine
CID 177203749
5-[4-(2,4-dimethylpentan-2-yl)piperidin-1-yl]-2,4,4,5-tetramethylhexan-3-one
CID 177062061
3-tert-butyl-1-(2-methylbutan-2-yl)pyrrolidine
CID 155259857
1,4,7,10-tetrakis(2-methylbutan-2-yl)-1,4,7,10-tetrazacyclododecane
CID 139847650
3-(2,4-dimethylpentan-2-yl)-1-propan-2-ylazetidine
CID 167001874
1-(cyclopropylmethyl)-4-[2,5-dimethyl-5-(4-propan-2-ylpiperidin-1-yl)hexan-2-yl]piperidine
CID 139501573
2-methyl-N-[[1-(2-methylbutan-2-yl)pyrrolidin-3-yl]methyl]propan-1-amine
CID 62512074
1,3-bis(2-methylbutan-2-yl)azetidine
CID 176964462
1-(2-methylbutan-2-yl)pyrrolidin-3-amine
CID 43315387
1-butan-2-yl-4-(2-methylbutan-2-yl)piperazine
CID 70907870
4-azido-1-(2-methylbutan-2-yl)piperidine
CID 141258940
1-tert-butyl-4-[2,5-dimethyl-5-(1-propan-2-ylpiperidin-4-yl)hexan-2-yl]piperazine
CID 138623766

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine?
The IUPAC name of 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine (CID 153330318) is 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine.
What is the SMILES notation for 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine?
The canonical SMILES for 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine is CCC(C)(C)N1CCC(C(C)(C)CC(C)C)CC1.
What is the InChIKey of 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine?
The InChIKey is HDWMZGAWWFJPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N/c1-8-17(6,7)18-11-9-15(10-12-18)16(4,5)13-14(2)3/h14-15H,8-13H2,1-7H3.
What are the key properties of 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine?
4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine has a molecular weight of 253.47 g/mol, XLogP of 4.96, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylpentan-2-yl)-1-(2-methylbutan-2-yl)piperidine is sourced from PubChem (CID 153330318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).