N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine

C10H17N3S — CID 112727052

IUPACN-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine
SMILESCC(CNc1nccs1)N1CCCC1
InChIInChI=1S/C10H17N3S/c1-9(13-5-2-3-6-13)8-12-10-11-4-7-14-10/h4,7,9H,2-3,5-6,8H2,1H3,(H,11,12)
InChIKeyNTTGVBYHWMVXET-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.04
Rot. Bonds4

About N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine

N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine (PubChem CID 112727052) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine
PubChem CID112727052
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC NameN-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine
SMILESCC(CNc1nccs1)N1CCCC1
InChIInChI=1S/C10H17N3S/c1-9(13-5-2-3-6-13)8-12-10-11-4-7-14-10/h4,7,9H,2-3,5-6,8H2,1H3,(H,11,12)
InChIKeyNTTGVBYHWMVXET-UHFFFAOYSA-N
XLogP2.04
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 4711878
N-(2-chloropropyl)-1,3-thiazol-2-amine
CID 65027252
1-(1,3-thiazol-2-ylamino)propan-2-ol
CID 43392072
4-chloro-N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine
CID 83152672
N-(2-piperidin-1-ylpropyl)pyrimidin-2-amine
CID 61017565
2-N-methyl-1-N-(1,3-thiazol-2-yl)propane-1,2-diamine
CID 130505496
N-(2-cyclopropylpropyl)-1,3-thiazol-2-amine
CID 115591460
N-(2-pyrrolidin-1-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 113222136
5-methyl-N-(2-piperidin-1-ylpropyl)-1,3,4-thiadiazol-2-amine
CID 65209322
N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
CID 60659943
(2S)-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)propanamide
CID 40932668
N'-propan-2-yl-N-(1,3-thiazol-2-yl)ethane-1,2-diamine
CID 20786153

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine (CID 112727052) is N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine is CC(CNc1nccs1)N1CCCC1.
What is the InChIKey of N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine?
The InChIKey is NTTGVBYHWMVXET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-9(13-5-2-3-6-13)8-12-10-11-4-7-14-10/h4,7,9H,2-3,5-6,8H2,1H3,(H,11,12).
What are the key properties of N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine?
N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine has a molecular weight of 211.33 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 112727052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).