N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide

C14H22N4O2S — CID 6470491

IUPACN,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide
SMILESCc1nc(NC(=O)CN2CCCCC2)sc1C(=O)N(C)C
InChIInChI=1S/C14H22N4O2S/c1-10-12(13(20)17(2)3)21-14(15-10)16-11(19)9-18-7-5-4-6-8-18/h4-9H2,1-3H3,(H,15,16,19)
InChIKeyFHWZRZKDVGZDQN-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.58
Rot. Bonds4

About N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide

N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide (PubChem CID 6470491) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide
PubChem CID6470491
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC NameN,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide
SMILESCc1nc(NC(=O)CN2CCCCC2)sc1C(=O)N(C)C
InChIInChI=1S/C14H22N4O2S/c1-10-12(13(20)17(2)3)21-14(15-10)16-11(19)9-18-7-5-4-6-8-18/h4-9H2,1-3H3,(H,15,16,19)
InChIKeyFHWZRZKDVGZDQN-UHFFFAOYSA-N
XLogP1.58
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide?
The IUPAC name of N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide (CID 6470491) is N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide?
The canonical SMILES for N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide is Cc1nc(NC(=O)CN2CCCCC2)sc1C(=O)N(C)C.
What is the InChIKey of N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide?
The InChIKey is FHWZRZKDVGZDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c1-10-12(13(20)17(2)3)21-14(15-10)16-11(19)9-18-7-5-4-6-8-18/h4-9H2,1-3H3,(H,15,16,19).
What are the key properties of N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide?
N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide has a molecular weight of 310.42 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-[(2-piperidin-1-ylacetyl)amino]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 6470491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).