N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide

C12H16N4OS — CID 139004286

IUPACN-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)N(C)c2cnn(C)c2)s1
InChIInChI=1S/C12H16N4OS/c1-4-5-11-13-7-10(18-11)12(17)16(3)9-6-14-15(2)8-9/h6-8H,4-5H2,1-3H3
InChIKeyIPVIZUUEWBADNF-UHFFFAOYSA-N
MW264.35 g/mol
LogP2.11
Rot. Bonds4

About N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide

N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide (PubChem CID 139004286) has the molecular formula C12H16N4OS and a molecular weight of 264.35 g/mol. Its IUPAC name is N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide
PubChem CID139004286
Molecular FormulaC12H16N4OS
Molecular Weight264.35 g/mol
Exact Mass264.10
IUPAC NameN-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)N(C)c2cnn(C)c2)s1
InChIInChI=1S/C12H16N4OS/c1-4-5-11-13-7-10(18-11)12(17)16(3)9-6-14-15(2)8-9/h6-8H,4-5H2,1-3H3
InChIKeyIPVIZUUEWBADNF-UHFFFAOYSA-N
XLogP2.11
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-[methyl-(2-propyl-1,3-thiazole-5-carbonyl)amino]acetyl]piperidine-4-carboxylic acid
CID 119235721
2-[propyl-(2-propyl-1,3-thiazole-5-carbonyl)amino]acetic acid
CID 119204826
N,2-dipropyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119533233
2-[methyl-(1-methylpyrazol-4-yl)amino]acetic acid
CID 82538136
N-[(1S,2S)-2-hydroxycyclohexyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 126793620
[(3R)-3-hydroxypyrrolidin-1-yl]-(2-propyl-1,3-thiazol-5-yl)methanone
CID 111560884
(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride
CID 130617270
2-(2-aminoethyl)-N-methoxy-N-methyl-1,3-thiazole-5-carboxamide
CID 165451079
N-(1-amino-2-cyclopropylpropan-2-yl)-2-propyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119576047
1-methyl-N,N-bis(tripropylsilyl)pyrazol-4-amine
CID 140624353
3-(2-amino-2-oxoethoxy)-N-methyl-N-(1-methylpyrazol-4-yl)benzamide
CID 136528003
N-(6-amino-1,3-benzodioxol-5-yl)-2-propyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119619097

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide (CID 139004286) is N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide is CCCc1ncc(C(=O)N(C)c2cnn(C)c2)s1.
What is the InChIKey of N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide?
The InChIKey is IPVIZUUEWBADNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4OS/c1-4-5-11-13-7-10(18-11)12(17)16(3)9-6-14-15(2)8-9/h6-8H,4-5H2,1-3H3.
What are the key properties of N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide?
N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide has a molecular weight of 264.35 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpyrazol-4-yl)-2-propyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 139004286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).