4-(1-aminopropyl)-1,3-thiazol-2-amine

C6H11N3S — CID 82415862

IUPAC4-(1-aminopropyl)-1,3-thiazol-2-amine
SMILESCCC(N)c1csc(N)n1
InChIInChI=1S/C6H11N3S/c1-2-4(7)5-3-10-6(8)9-5/h3-4H,2,7H2,1H3,(H2,8,9)
InChIKeyRKPOWJWROVJKLF-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.14
Rot. Bonds2

About 4-(1-aminopropyl)-1,3-thiazol-2-amine

4-(1-aminopropyl)-1,3-thiazol-2-amine (PubChem CID 82415862) has the molecular formula C6H11N3S and a molecular weight of 157.24 g/mol. Its IUPAC name is 4-(1-aminopropyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1-aminopropyl)-1,3-thiazol-2-amine
PubChem CID82415862
Molecular FormulaC6H11N3S
Molecular Weight157.24 g/mol
Exact Mass157.07
IUPAC Name4-(1-aminopropyl)-1,3-thiazol-2-amine
SMILESCCC(N)c1csc(N)n1
InChIInChI=1S/C6H11N3S/c1-2-4(7)5-3-10-6(8)9-5/h3-4H,2,7H2,1H3,(H2,8,9)
InChIKeyRKPOWJWROVJKLF-UHFFFAOYSA-N
XLogP1.14
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-aminoethyl)-1,3-thiazol-2-amine
CID 64545491
4-(2,4-dimethylpentan-3-yl)-1,3-thiazol-2-amine
CID 130517444
4-(3-methylbutan-2-yl)-1,3-thiazol-2-amine
CID 58125052
chloro 2-(2-amino-1,3-thiazol-4-yl)butanoate
CID 174643774
4-[1-(methylamino)ethyl]-1,3-thiazol-2-amine
CID 64543676
4-[ethoxy(phenyl)methyl]-1,3-thiazol-2-amine
CID 121010363
2-[2-(2-amino-1,3-thiazol-4-yl)butoxyimino]acetaldehyde
CID 54263586
(1S)-1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine
CID 42078005
(1S)-1-(2-methyl-1,3-thiazol-4-yl)ethane-1,2-diamine
CID 55296429
4-[1-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-thiazol-2-amine
CID 87544194
2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyacetaldehyde
CID 54337328
1-bromo-3-methylbutan-2-one;4-propan-2-yl-1,3-thiazol-2-amine
CID 87581796

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminopropyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1-aminopropyl)-1,3-thiazol-2-amine (CID 82415862) is 4-(1-aminopropyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1-aminopropyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1-aminopropyl)-1,3-thiazol-2-amine is CCC(N)c1csc(N)n1.
What is the InChIKey of 4-(1-aminopropyl)-1,3-thiazol-2-amine?
The InChIKey is RKPOWJWROVJKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3S/c1-2-4(7)5-3-10-6(8)9-5/h3-4H,2,7H2,1H3,(H2,8,9).
What are the key properties of 4-(1-aminopropyl)-1,3-thiazol-2-amine?
4-(1-aminopropyl)-1,3-thiazol-2-amine has a molecular weight of 157.24 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminopropyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 82415862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).