N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine

C10H12N4S — CID 107588313

IUPACN-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine
SMILESCCc1ncc(CNc2cncnc2)s1
InChIInChI=1S/C10H12N4S/c1-2-10-14-6-9(15-10)5-13-8-3-11-7-12-4-8/h3-4,6-7,13H,2,5H2,1H3
InChIKeyDOXNMSMZGLGCDU-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.11
Rot. Bonds4

About N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine

N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine (PubChem CID 107588313) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine.

Molecular Properties

Compound NameN-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine
PubChem CID107588313
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC NameN-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine
SMILESCCc1ncc(CNc2cncnc2)s1
InChIInChI=1S/C10H12N4S/c1-2-10-14-6-9(15-10)5-13-8-3-11-7-12-4-8/h3-4,6-7,13H,2,5H2,1H3
InChIKeyDOXNMSMZGLGCDU-UHFFFAOYSA-N
XLogP2.11
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-tert-butyl-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline
CID 54883751
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-3,4-dimethylaniline
CID 54883704
5-ethyl-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 115924677
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-4-nitroaniline
CID 54883135
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-3-iodo-4-methylaniline
CID 54883715
1-[4-[(2-ethyl-1,3-thiazol-5-yl)methylamino]phenyl]-3-methylurea
CID 60983648
4-(difluoromethoxy)-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline
CID 54883371
1-(2-ethyl-1,3-thiazol-5-yl)-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]methanamine
CID 103741081
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2,2-dimethyl-1,3-benzodioxol-5-amine
CID 60982260
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-methylaniline
CID 60983133
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-methylbut-3-yn-2-amine
CID 63998554
2-ethyl-5-[[3-(sulfamoylamino)anilino]methyl]-1,3-thiazole
CID 60983417

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine?
The IUPAC name of N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine (CID 107588313) is N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine.
What is the SMILES notation for N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine?
The canonical SMILES for N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine is CCc1ncc(CNc2cncnc2)s1.
What is the InChIKey of N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine?
The InChIKey is DOXNMSMZGLGCDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-2-10-14-6-9(15-10)5-13-8-3-11-7-12-4-8/h3-4,6-7,13H,2,5H2,1H3.
What are the key properties of N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine?
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine has a molecular weight of 220.30 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethyl-1,3-thiazol-5-yl)methyl]pyrimidin-5-amine is sourced from PubChem (CID 107588313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).