2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine

C10H18N4S — CID 102767910

IUPAC2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine
SMILESCC(CN1CCCC1)Nc1ncc(N)s1
InChIInChI=1S/C10H18N4S/c1-8(7-14-4-2-3-5-14)13-10-12-6-9(11)15-10/h6,8H,2-5,7,11H2,1H3,(H,12,13)
InChIKeyMLKFJHRBVLGYJY-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.62
Rot. Bonds4

About 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine

2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine (PubChem CID 102767910) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine
PubChem CID102767910
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC Name2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine
SMILESCC(CN1CCCC1)Nc1ncc(N)s1
InChIInChI=1S/C10H18N4S/c1-8(7-14-4-2-3-5-14)13-10-12-6-9(11)15-10/h6,8H,2-5,7,11H2,1H3,(H,12,13)
InChIKeyMLKFJHRBVLGYJY-UHFFFAOYSA-N
XLogP1.62
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-piperidin-1-ylpropan-2-ylamino)-1,3-thiazole-5-carboxylic acid
CID 80571509
2-N-(1-ethylsulfanylpropan-2-yl)-1,3-thiazole-2,5-diamine
CID 102769066
4-N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4,5-diamine
CID 82239020
5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine
CID 61474336
2-N-(3-ethylpentan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768492
N-(1-piperidin-1-ylpropan-2-yl)-1,3-benzothiazol-2-amine
CID 54937957
4-chloro-N-(1-piperidin-1-ylpropan-2-yl)-1,3-thiazol-2-amine
CID 83152888
1-methyl-N-(1-piperidin-1-ylpropan-2-yl)imidazol-2-amine
CID 62133475
3-ethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,2,4-thiadiazol-5-amine
CID 65276551
6-chloro-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,5-diamine
CID 63022906
6-hydrazinyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrazin-2-amine
CID 80897850
6-chloro-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-benzothiazol-2-amine
CID 79526067

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine?
The IUPAC name of 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine (CID 102767910) is 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine?
The canonical SMILES for 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine is CC(CN1CCCC1)Nc1ncc(N)s1.
What is the InChIKey of 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine?
The InChIKey is MLKFJHRBVLGYJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-8(7-14-4-2-3-5-14)13-10-12-6-9(11)15-10/h6,8H,2-5,7,11H2,1H3,(H,12,13).
What are the key properties of 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine?
2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine has a molecular weight of 226.35 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 102767910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).