N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine

C17H22N4S — CID 110265111

IUPACN-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
SMILESCc1cnc(Nc2cccc(C3CCCN3CC3CC3)n2)s1
InChIInChI=1S/C17H22N4S/c1-12-10-18-17(22-12)20-16-6-2-4-14(19-16)15-5-3-9-21(15)11-13-7-8-13/h2,4,6,10,13,15H,3,5,7-9,11H2,1H3,(H,18,19,20)
InChIKeyGEGBCGDVTKOOLR-UHFFFAOYSA-N
MW314.46 g/mol
LogP4.14
Rot. Bonds5

About N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine

N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine (PubChem CID 110265111) has the molecular formula C17H22N4S and a molecular weight of 314.46 g/mol. Its IUPAC name is N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
PubChem CID110265111
Molecular FormulaC17H22N4S
Molecular Weight314.46 g/mol
Exact Mass314.16
IUPAC NameN-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
SMILESCc1cnc(Nc2cccc(C3CCCN3CC3CC3)n2)s1
InChIInChI=1S/C17H22N4S/c1-12-10-18-17(22-12)20-16-6-2-4-14(19-16)15-5-3-9-21(15)11-13-7-8-13/h2,4,6,10,13,15H,3,5,7-9,11H2,1H3,(H,18,19,20)
InChIKeyGEGBCGDVTKOOLR-UHFFFAOYSA-N
XLogP4.14
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.46
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-[1-[(5-fluoro-2-pyridinyl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
CID 175659043
2-amino-1-[(2R)-2-[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95842802
5-methyl-N-[6-[1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-yl]-1,3-thiazol-2-amine
CID 175659672
5-methyl-N-[2-[(2S)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 175658940
4,6-dimethyl-1-[3-[2-[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]pyrrolidin-1-yl]-3-oxopropyl]pyrimidin-2-one
CID 110265230
2-[[6-[1-[[2-(dimethylamino)pyrimidin-5-yl]methyl]pyrrolidin-2-yl]-2-pyridinyl]amino]-1,3-thiazole-5-carbonitrile
CID 132778397
2-[2-[6-[(4-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]pyrrolidin-1-yl]ethanol
CID 110268824
N-[6-[1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]piperidin-3-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
CID 132778206
cyclopentyl-[2-[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]morpholin-4-yl]methanone
CID 155984921
2-[[6-[1-[(2-butyl-1H-imidazol-5-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]amino]-1,3-thiazole-5-carbonitrile
CID 132778416
5-methyl-N-[6-(piperidin-4-ylmethyl)-2-pyridinyl]-1,3-thiazol-2-amine
CID 155906903
5-[4-[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]piperidine-1-carbonyl]pyrrolidin-2-one
CID 132765731

Frequently Asked Questions

What is the IUPAC name of N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine (CID 110265111) is N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine is Cc1cnc(Nc2cccc(C3CCCN3CC3CC3)n2)s1.
What is the InChIKey of N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
The InChIKey is GEGBCGDVTKOOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4S/c1-12-10-18-17(22-12)20-16-6-2-4-14(19-16)15-5-3-9-21(15)11-13-7-8-13/h2,4,6,10,13,15H,3,5,7-9,11H2,1H3,(H,18,19,20).
What are the key properties of N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine has a molecular weight of 314.46 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[1-(cyclopropylmethyl)pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 110265111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).