N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide

C16H33N3O — CID 83262362

IUPACN,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NC(C)(C)CC(C)(C)C)CC1
InChIInChI=1S/C16H33N3O/c1-15(2,3)12-16(4,5)17-13-8-10-19(11-9-13)14(20)18(6)7/h13,17H,8-12H2,1-7H3
InChIKeyKTTOBQYJHLLFFM-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.94
Rot. Bonds3

About N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide

N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide (PubChem CID 83262362) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide
PubChem CID83262362
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NC(C)(C)CC(C)(C)C)CC1
InChIInChI=1S/C16H33N3O/c1-15(2,3)12-16(4,5)17-13-8-10-19(11-9-13)14(20)18(6)7/h13,17H,8-12H2,1-7H3
InChIKeyKTTOBQYJHLLFFM-UHFFFAOYSA-N
XLogP2.94
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-(tert-butylamino)-2-oxoethyl]amino]-N,N-dimethylpiperidine-1-carboxamide
CID 83201902
4-(cyclopropanecarbonylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 108561749
4-(cyclopropylmethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 115307162
tert-butyl 2-[[1-(dimethylcarbamoyl)piperidin-4-yl]amino]acetate
CID 75444294
4-(cyclohexylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 83199527
tert-butyl N-[2-[[1-(dimethylcarbamoyl)piperidin-4-yl]amino]-2-oxoethyl]carbamate
CID 108558901
tert-butyl N-[3-[[1-(dimethylcarbamoyl)piperidin-4-yl]amino]-3-oxopropyl]carbamate
CID 108558938
4-(1-cyclopropylethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 83198312
(3R)-3-(2,2-dimethylpropyl)-N,N-dimethylpyrrolidine-1-carboxamide
CID 164775319
methyl 2-[[1-(dimethylcarbamoyl)piperidin-4-yl]amino]acetate
CID 83224585
N-(2,4,4-trimethylpentan-2-yl)cyclooctanamine
CID 43434257
N-(2,4,4-trimethylpentan-2-yl)cycloheptanamine
CID 43434260

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide (CID 83262362) is N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide is CN(C)C(=O)N1CCC(NC(C)(C)CC(C)(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide?
The InChIKey is KTTOBQYJHLLFFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-15(2,3)12-16(4,5)17-13-8-10-19(11-9-13)14(20)18(6)7/h13,17H,8-12H2,1-7H3.
What are the key properties of N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide?
N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide has a molecular weight of 283.46 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2,4,4-trimethylpentan-2-ylamino)piperidine-1-carboxamide is sourced from PubChem (CID 83262362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).