4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide

C15H30N2O — CID 114423167

IUPAC4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide
SMILESCC1CCNC(C(=O)NC(C)(C)CC(C)(C)C)C1
InChIInChI=1S/C15H30N2O/c1-11-7-8-16-12(9-11)13(18)17-15(5,6)10-14(2,3)4/h11-12,16H,7-10H2,1-6H3,(H,17,18)
InChIKeyGCBYRSZZBXONFB-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds3

About 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide

4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide (PubChem CID 114423167) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide
PubChem CID114423167
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide
SMILESCC1CCNC(C(=O)NC(C)(C)CC(C)(C)C)C1
InChIInChI=1S/C15H30N2O/c1-11-7-8-16-12(9-11)13(18)17-15(5,6)10-14(2,3)4/h11-12,16H,7-10H2,1-6H3,(H,17,18)
InChIKeyGCBYRSZZBXONFB-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-3-[(4-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 113342121
4-methylpiperidine-2-carbohydrazide
CID 114424068
N-(2,2-dimethylbutyl)-4-methylpiperidine-2-carboxamide
CID 103461667
4-methyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidine-2-carboxamide
CID 114422931
4,4-dimethyl-2-[[(4-methylpiperidine-2-carbonyl)amino]methyl]pentanoic acid
CID 107475534
N',N',4-trimethylpiperidine-2-carbohydrazide
CID 114424419
4-methyl-N-methylsulfonylpiperidine-2-carboxamide
CID 103287766
2-methyl-2-[[(4-methylpiperidine-2-carbonyl)amino]methyl]butanoic acid
CID 114424387
4-methyl-N-[(4-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114424006
N-(2,2-dichloroethyl)-4-methylpiperidine-2-carboxamide
CID 130551928
N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide
CID 114424587
N-[2-(carbamoylamino)ethyl]-4-methylpiperidine-2-carboxamide
CID 114424437

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide?
The IUPAC name of 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide (CID 114423167) is 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide.
What is the SMILES notation for 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide?
The canonical SMILES for 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide is CC1CCNC(C(=O)NC(C)(C)CC(C)(C)C)C1.
What is the InChIKey of 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide?
The InChIKey is GCBYRSZZBXONFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11-7-8-16-12(9-11)13(18)17-15(5,6)10-14(2,3)4/h11-12,16H,7-10H2,1-6H3,(H,17,18).
What are the key properties of 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide?
4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-2-carboxamide is sourced from PubChem (CID 114423167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).