N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine

C10H19N3S — CID 61477605

IUPACN-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(CN1CCCC1)NC1=NCCS1
InChIInChI=1S/C10H19N3S/c1-9(8-13-5-2-3-6-13)12-10-11-4-7-14-10/h9H,2-8H2,1H3,(H,11,12)
InChIKeyOXMCXTFXVMRYOX-UHFFFAOYSA-N
MW213.35 g/mol
LogP1.16
Rot. Bonds3

About N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine

N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 61477605) has the molecular formula C10H19N3S and a molecular weight of 213.35 g/mol. Its IUPAC name is N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID61477605
Molecular FormulaC10H19N3S
Molecular Weight213.35 g/mol
Exact Mass213.13
IUPAC NameN-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(CN1CCCC1)NC1=NCCS1
InChIInChI=1S/C10H19N3S/c1-9(8-13-5-2-3-6-13)12-10-11-4-7-14-10/h9H,2-8H2,1H3,(H,11,12)
InChIKeyOXMCXTFXVMRYOX-UHFFFAOYSA-N
XLogP1.16
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,4-diethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazolidin-2-imine
CID 136022770
1-[(4-ethyl-1,3-thiazolidin-2-ylidene)amino]-N,N-dimethylpropan-2-amine
CID 136162430
2-[(4,4-dimethyl-1,3-thiazolidin-2-ylidene)amino]-N-ethyl-N-methylethanamine
CID 136195661
4,4-dimethyl-N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazolidin-2-imine
CID 136279621
5-Methyl-2-pyrrolidin-1-ium-1-ylidene-1,3-thiazolidine bromide
CID 17365713
2-(2-pyrrolidin-1-ylethylsulfanyl)-4,5-dihydro-1H-imidazole
CID 13018884
2-(2-pyrrolidin-1-ylethylsulfanyl)-4,5-dihydro-1H-imidazole;dihydrochloride
CID 13018885
4-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N,N-dimethylbutan-1-amine
CID 20213259
N-pyrrolidin-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 57855145
(3aS,6aR)-N-cyclopropyl-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d][1,3]thiazol-2-amine
CID 67321336
2,3,5,6-Tetrahydroimidazo[2,1-b][1,3]thiazol-3-ylmethanamine
CID 68200001
N-[2-[2-[ethyl(methyl)amino]-4,5-dihydro-1H-imidazol-5-yl]ethyl]-N-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 129059236

Frequently Asked Questions

What is the IUPAC name of N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 61477605) is N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is CC(CN1CCCC1)NC1=NCCS1.
What is the InChIKey of N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is OXMCXTFXVMRYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3S/c1-9(8-13-5-2-3-6-13)12-10-11-4-7-14-10/h9H,2-8H2,1H3,(H,11,12).
What are the key properties of N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 213.35 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrrolidin-1-ylpropan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 61477605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).