N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine

C9H15N3S — CID 71641107

IUPACN-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine
SMILESCN(c1nccs1)[C@H]1CCCNC1
InChIInChI=1S/C9H15N3S/c1-12(9-11-5-6-13-9)8-3-2-4-10-7-8/h5-6,8,10H,2-4,7H2,1H3/t8-/m0/s1
InChIKeyVGCMDPNOXVAPRB-QMMMGPOBSA-N
MW197.31 g/mol
LogP1.33
Rot. Bonds2

About N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine

N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine (PubChem CID 71641107) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine
PubChem CID71641107
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC NameN-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine
SMILESCN(c1nccs1)[C@H]1CCCNC1
InChIInChI=1S/C9H15N3S/c1-12(9-11-5-6-13-9)8-3-2-4-10-7-8/h5-6,8,10H,2-4,7H2,1H3/t8-/m0/s1
InChIKeyVGCMDPNOXVAPRB-QMMMGPOBSA-N
XLogP1.33
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-[(3R)-pyrrolidin-3-yl]-1,3-thiazol-2-amine;hydrochloride
CID 71641002
N-methyl-N-piperidin-4-yl-1,3-thiazol-2-amine;hydrochloride
CID 71641479
N-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]piperidin-3-amine
CID 64990579
N-ethyl-N-pyrrolidin-3-yl-1,3-thiazol-2-amine
CID 63300017
2-[methyl-[(3R)-piperidin-3-yl]amino]-1-(1,3-thiazol-2-yl)ethanone
CID 71641614
N-methyl-N-piperidin-3-ylpyridin-3-amine
CID 83698004
2-N,2-N,4-N-trimethyl-4-N-piperidin-3-ylpyrimidine-2,4-diamine
CID 64830287
3-ethyl-N-methyl-N-piperidin-3-yl-1,2,4-thiadiazol-5-amine
CID 65276221
N-methyl-N-[(3R)-piperidin-3-yl]-1,3-benzothiazol-2-amine;hydrochloride
CID 71640920
4-N,6-N-dimethyl-6-N-piperidin-3-yl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 115265979
5-ethyl-N-methyl-N-piperidin-3-ylpyrimidin-2-amine
CID 116977534
6-ethoxy-N-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 66319466

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine (CID 71641107) is N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine is CN(c1nccs1)[C@H]1CCCNC1.
What is the InChIKey of N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine?
The InChIKey is VGCMDPNOXVAPRB-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H15N3S/c1-12(9-11-5-6-13-9)8-3-2-4-10-7-8/h5-6,8,10H,2-4,7H2,1H3/t8-/m0/s1.
What are the key properties of N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine?
N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine has a molecular weight of 197.31 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 71641107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).