5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine

C15H23N5S — CID 103360020

IUPAC5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
SMILESCC(C)C(CN(C)C)Nc1snc(N)c1-c1ccncc1
InChIInChI=1S/C15H23N5S/c1-10(2)12(9-20(3)4)18-15-13(14(16)19-21-15)11-5-7-17-8-6-11/h5-8,10,12,18H,9H2,1-4H3,(H2,16,19)
InChIKeyRWHAKQPDKBCQRF-UHFFFAOYSA-N
MW305.45 g/mol
LogP2.79
Rot. Bonds6

About 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine

5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine (PubChem CID 103360020) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
PubChem CID103360020
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
SMILESCC(C)C(CN(C)C)Nc1snc(N)c1-c1ccncc1
InChIInChI=1S/C15H23N5S/c1-10(2)12(9-20(3)4)18-15-13(14(16)19-21-15)11-5-7-17-8-6-11/h5-8,10,12,18H,9H2,1-4H3,(H2,16,19)
InChIKeyRWHAKQPDKBCQRF-UHFFFAOYSA-N
XLogP2.79
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine with MolForge

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Related Compounds

4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 103363995
5-N-(3-methylpentan-2-yl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103359578
2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide
CID 103359608
4-pyridin-4-yl-5-N-(2,3,3-trimethylbutyl)-1,2-thiazole-3,5-diamine
CID 103365005
5-N-(1-ethoxypropan-2-yl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103360282
4-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]butan-2-ol
CID 103359777
2-N-(2,1-benzothiazol-3-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 66355507
5-N-[4-(dimethylamino)butan-2-yl]-4-pyridin-3-yl-1,2-thiazole-3,5-diamine
CID 103360134
3-N-[1-(dimethylamino)-3-methylbutan-2-yl]pyrazine-2,3-diamine
CID 102984055
4-pyridin-4-yl-5-N-(1,3-thiazol-5-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103365701
3-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-2,2-difluoropropan-1-ol
CID 106174702
4-(2-methyl-1,3-thiazol-4-yl)-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 103382912

Frequently Asked Questions

What is the IUPAC name of 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine (CID 103360020) is 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine is CC(C)C(CN(C)C)Nc1snc(N)c1-c1ccncc1.
What is the InChIKey of 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine?
The InChIKey is RWHAKQPDKBCQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-10(2)12(9-20(3)4)18-15-13(14(16)19-21-15)11-5-7-17-8-6-11/h5-8,10,12,18H,9H2,1-4H3,(H2,16,19).
What are the key properties of 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine?
5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine has a molecular weight of 305.45 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103360020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).