(3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide

C14H22N2O — CID 124623554

IUPAC(3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide
SMILESCC[C@H](C)CC(=O)Nc1c(C)cc(C)nc1C
InChIInChI=1S/C14H22N2O/c1-6-9(2)7-13(17)16-14-10(3)8-11(4)15-12(14)5/h8-9H,6-7H2,1-5H3,(H,16,17)/t9-/m0/s1
InChIKeyNNAYTGFTGKLSFW-VIFPVBQESA-N
MW234.34 g/mol
LogP3.38
Rot. Bonds4

About (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide

(3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide (PubChem CID 124623554) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide.

Molecular Properties

Compound Name(3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide
PubChem CID124623554
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide
SMILESCC[C@H](C)CC(=O)Nc1c(C)cc(C)nc1C
InChIInChI=1S/C14H22N2O/c1-6-9(2)7-13(17)16-14-10(3)8-11(4)15-12(14)5/h8-9H,6-7H2,1-5H3,(H,16,17)/t9-/m0/s1
InChIKeyNNAYTGFTGKLSFW-VIFPVBQESA-N
XLogP3.38
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 586045
2-propylsulfanyl-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 87024291
2-(4-butylphenyl)-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 78859538
3-(2-methylpropoxy)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78873454
3-(4-ethylphenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78859486
4-phenyl-N-(2,4,6-trimethyl-3-pyridinyl)butanamide
CID 78883201
4-(butan-2-ylsulfamoyl)-N-(2,4,6-trimethyl-3-pyridinyl)benzamide
CID 78859795
N-(2,4-dimethylphenyl)-3-methylpentanamide
CID 54564506
4-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)butanamide
CID 78888932
2-(2,6-dimethylphenoxy)-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 78859856
3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78837758
N-(4-chloro-2-pyridinyl)-3-methylpentanamide
CID 114877777

Frequently Asked Questions

What is the IUPAC name of (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide?
The IUPAC name of (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide (CID 124623554) is (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide.
What is the SMILES notation for (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide?
The canonical SMILES for (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide is CC[C@H](C)CC(=O)Nc1c(C)cc(C)nc1C.
What is the InChIKey of (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide?
The InChIKey is NNAYTGFTGKLSFW-VIFPVBQESA-N. The full InChI is InChI=1S/C14H22N2O/c1-6-9(2)7-13(17)16-14-10(3)8-11(4)15-12(14)5/h8-9H,6-7H2,1-5H3,(H,16,17)/t9-/m0/s1.
What are the key properties of (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide?
(3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide has a molecular weight of 234.34 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-N-(2,4,6-trimethyl-3-pyridinyl)pentanamide is sourced from PubChem (CID 124623554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).