N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide

C12H23N3OS — CID 63234484

IUPACN-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCN1CCC(CN(C)C(=O)C2CSCN2)CC1
InChIInChI=1S/C12H23N3OS/c1-14-5-3-10(4-6-14)7-15(2)12(16)11-8-17-9-13-11/h10-11,13H,3-9H2,1-2H3
InChIKeyLSKALDIKSFEYSK-UHFFFAOYSA-N
MW257.40 g/mol
LogP0.45
Rot. Bonds3

About N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide

N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 63234484) has the molecular formula C12H23N3OS and a molecular weight of 257.40 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
PubChem CID63234484
Molecular FormulaC12H23N3OS
Molecular Weight257.40 g/mol
Exact Mass257.16
IUPAC NameN-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCN1CCC(CN(C)C(=O)C2CSCN2)CC1
InChIInChI=1S/C12H23N3OS/c1-14-5-3-10(4-6-14)7-15(2)12(16)11-8-17-9-13-11/h10-11,13H,3-9H2,1-2H3
InChIKeyLSKALDIKSFEYSK-UHFFFAOYSA-N
XLogP0.45
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.40
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,4-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]piperazine-2-carboxamide
CID 115178047
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 55174038
N-[(1-benzylpyrrolidin-3-yl)methyl]-N-methyl-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119885001
N-[2-(dimethylamino)ethyl]-N-methyl-1,3-thiazolidine-4-carboxamide
CID 63695214
(2R,5S)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]carbamoyl]oxolane-2-carboxylic acid
CID 102945243
N-(3-hydroxybutyl)-N-methyl-1,3-thiazolidine-4-carboxamide
CID 115734496
2-[cyclopropylmethyl(1,3-thiazolidine-4-carbonyl)amino]acetic acid
CID 61161421
3-amino-1-methyl-1-[(1-methylpiperidin-4-yl)methyl]urea
CID 115192849
N-methoxy-N-methyl-1,3-thiazolidine-4-carboxamide
CID 22922472
N-ethyl-N-hydroxy-1,3-thiazolidine-4-carboxamide
CID 131080910
2-methoxy-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]acetamide
CID 63297553
N,1-dimethyl-N-(1,3-thiazolidin-4-ylmethyl)piperidin-4-amine
CID 43199704

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide (CID 63234484) is N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide is CN1CCC(CN(C)C(=O)C2CSCN2)CC1.
What is the InChIKey of N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is LSKALDIKSFEYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3OS/c1-14-5-3-10(4-6-14)7-15(2)12(16)11-8-17-9-13-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 257.40 g/mol, XLogP of 0.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 63234484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).