4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide

C16H27N3OS — CID 119824556

IUPAC4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide
SMILESCCCc1nc(C)c(C(=O)N(CCC)C2CCNCC2)s1
InChIInChI=1S/C16H27N3OS/c1-4-6-14-18-12(3)15(21-14)16(20)19(11-5-2)13-7-9-17-10-8-13/h13,17H,4-11H2,1-3H3
InChIKeyGZVFQOUHCBCPCW-UHFFFAOYSA-N
MW309.48 g/mol
LogP3.01
Rot. Bonds6

About 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide

4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide (PubChem CID 119824556) has the molecular formula C16H27N3OS and a molecular weight of 309.48 g/mol. Its IUPAC name is 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide
PubChem CID119824556
Molecular FormulaC16H27N3OS
Molecular Weight309.48 g/mol
Exact Mass309.19
IUPAC Name4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide
SMILESCCCc1nc(C)c(C(=O)N(CCC)C2CCNCC2)s1
InChIInChI=1S/C16H27N3OS/c1-4-6-14-18-12(3)15(21-14)16(20)19(11-5-2)13-7-9-17-10-8-13/h13,17H,4-11H2,1-3H3
InChIKeyGZVFQOUHCBCPCW-UHFFFAOYSA-N
XLogP3.01
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.48
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-fluorophenyl)methyl]-4-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119530004
2-[(4-chlorophenoxy)methyl]-4-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119532088
4-methyl-N-propyl-2-pyrimidin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119533114
4-ethyl-N-piperidin-4-yl-N-propylthiadiazole-5-carboxamide
CID 65209875
N,2-dipropyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119533233
2-(4-chlorophenyl)-4-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119532106
3-chloro-N-piperidin-4-yl-N-propylthiophene-2-carboxamide
CID 80642602
2,5-dichloro-N-piperidin-4-yl-N-propylthiophene-3-carboxamide;hydrochloride
CID 119824416
4-methyl-2-[[[methyl(piperidin-4-yl)carbamoyl]amino]methyl]-1,3-thiazole-5-carboxylic acid
CID 63630361
2-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119533138
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494
3,5-dimethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824323

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide (CID 119824556) is 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide is CCCc1nc(C)c(C(=O)N(CCC)C2CCNCC2)s1.
What is the InChIKey of 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide?
The InChIKey is GZVFQOUHCBCPCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3OS/c1-4-6-14-18-12(3)15(21-14)16(20)19(11-5-2)13-7-9-17-10-8-13/h13,17H,4-11H2,1-3H3.
What are the key properties of 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide?
4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide has a molecular weight of 309.48 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-piperidin-4-yl-N,2-dipropyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 119824556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).