2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide

C14H18N4OS — CID 71689290

IUPAC2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)N(C)Cc2cccs2)nc(N(C)C)n1
InChIInChI=1S/C14H18N4OS/c1-10-8-12(16-14(15-10)17(2)3)13(19)18(4)9-11-6-5-7-20-11/h5-8H,9H2,1-4H3
InChIKeyALGOQSCAFHIXFA-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.18
Rot. Bonds4

About 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide

2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 71689290) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID71689290
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC Name2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)N(C)Cc2cccs2)nc(N(C)C)n1
InChIInChI=1S/C14H18N4OS/c1-10-8-12(16-14(15-10)17(2)3)13(19)18(4)9-11-6-5-7-20-11/h5-8H,9H2,1-4H3
InChIKeyALGOQSCAFHIXFA-UHFFFAOYSA-N
XLogP2.18
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,6-dimethyl-2-piperidin-1-yl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide
CID 56731013
6-amino-N-methyl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 62238783
N-methyl-2-(4-methylphenyl)-N-(thiophen-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 18114181
N,3,6-trimethyl-N-(thiophen-2-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 18162206
N-methyl-N-(thiophen-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 63050087
N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide
CID 51205761
3,6-dichloro-N-methyl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 43395968
2-amino-6-chloro-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 62154274
3-amino-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527201
N-methyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 110733634
2-chloro-N-methyl-N-(thiophen-2-ylmethyl)quinoline-4-carboxamide
CID 18208948
3-ethyl-1-methyl-1-(thiophen-2-ylmethyl)urea
CID 53016484

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide (CID 71689290) is 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide is Cc1cc(C(=O)N(C)Cc2cccs2)nc(N(C)C)n1.
What is the InChIKey of 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is ALGOQSCAFHIXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-10-8-12(16-14(15-10)17(2)3)13(19)18(4)9-11-6-5-7-20-11/h5-8H,9H2,1-4H3.
What are the key properties of 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide?
2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 71689290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).