N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine

C13H21N3S — CID 79719436

IUPACN-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine
SMILESCc1csc(N(CC2CCNCC2)C2CC2)n1
InChIInChI=1S/C13H21N3S/c1-10-9-17-13(15-10)16(12-2-3-12)8-11-4-6-14-7-5-11/h9,11-12,14H,2-8H2,1H3
InChIKeyQKVCPVYKWJWXSL-UHFFFAOYSA-N
MW251.40 g/mol
LogP2.42
Rot. Bonds4

About N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine

N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 79719436) has the molecular formula C13H21N3S and a molecular weight of 251.40 g/mol. Its IUPAC name is N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine
PubChem CID79719436
Molecular FormulaC13H21N3S
Molecular Weight251.40 g/mol
Exact Mass251.15
IUPAC NameN-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine
SMILESCc1csc(N(CC2CCNCC2)C2CC2)n1
InChIInChI=1S/C13H21N3S/c1-10-9-17-13(15-10)16(12-2-3-12)8-11-4-6-14-7-5-11/h9,11-12,14H,2-8H2,1H3
InChIKeyQKVCPVYKWJWXSL-UHFFFAOYSA-N
XLogP2.42
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-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

4-N-ethyl-4-N-(4-methyl-1,3-thiazol-2-yl)cyclohexane-1,4-diamine
CID 79112426
N-(2-chloroethyl)-N-cyclohexyl-4-methyl-1,3-thiazol-2-amine
CID 63388279
N-cyclopropyl-N-(piperidin-4-ylmethyl)pyrimidin-2-amine
CID 79720212
N'-cyclobutyl-N'-(4-methyl-1,3-thiazol-2-yl)propane-1,3-diamine
CID 102874488
4-[cyclopropyl(piperidin-4-ylmethyl)amino]-2,6-dimethylpyridine-3-carbonitrile
CID 81035702
4-methyl-2-piperidin-4-yl-1,3-thiazole
CID 23404938
N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114400593
3-bromo-N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)pyridin-2-amine
CID 106876188
1-(4-methyl-1,3-thiazol-2-yl)-3-piperidin-4-ylpropan-2-one
CID 116559994
N-cyclopropyl-6-ethoxy-N-(piperidin-4-ylmethyl)pyridin-2-amine
CID 79719364
4-methyl-2-[(3R)-pyrrolidin-3-yl]-1,3-thiazole
CID 93492448
4-methyl-N-piperidin-4-yl-1,3-thiazol-2-amine
CID 24708198

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine (CID 79719436) is N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine is Cc1csc(N(CC2CCNCC2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is QKVCPVYKWJWXSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3S/c1-10-9-17-13(15-10)16(12-2-3-12)8-11-4-6-14-7-5-11/h9,11-12,14H,2-8H2,1H3.
What are the key properties of N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine?
N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 251.40 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 79719436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).