N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine

C16H21N3S — CID 103625271

IUPACN-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine
SMILESCc1ncc(CNC2CCN(c3ccccc3)CC2)s1
InChIInChI=1S/C16H21N3S/c1-13-17-11-16(20-13)12-18-14-7-9-19(10-8-14)15-5-3-2-4-6-15/h2-6,11,14,18H,7-10,12H2,1H3
InChIKeyZYPGMSXAHMZTPG-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.21
Rot. Bonds4

About N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine

N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine (PubChem CID 103625271) has the molecular formula C16H21N3S and a molecular weight of 287.43 g/mol. Its IUPAC name is N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine
PubChem CID103625271
Molecular FormulaC16H21N3S
Molecular Weight287.43 g/mol
Exact Mass287.15
IUPAC NameN-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine
SMILESCc1ncc(CNC2CCN(c3ccccc3)CC2)s1
InChIInChI=1S/C16H21N3S/c1-13-17-11-16(20-13)12-18-14-7-9-19(10-8-14)15-5-3-2-4-6-15/h2-6,11,14,18H,7-10,12H2,1H3
InChIKeyZYPGMSXAHMZTPG-UHFFFAOYSA-N
XLogP3.21
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-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

1-phenyl-N-(1,3-thiazol-5-ylmethyl)piperidin-4-amine
CID 103792728
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine
CID 103096785
N-[(5-methylpyrazin-2-yl)methyl]-1-phenylpiperidin-4-amine
CID 103778023
(4R)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]oxepan-4-amine
CID 124509220
N-[(3-methyl-2-pyridinyl)methyl]-1-phenylpiperidin-4-amine
CID 103782068
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62704086
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-pyrimidin-2-ylpiperidin-3-amine
CID 60937187
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-phenylpiperidin-4-amine
CID 103625283
(3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-amine
CID 30675416
1-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-amine
CID 45171415
N-[(2-methyl-1,3-thiazol-5-yl)methyl]oxetan-3-amine
CID 63622731
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1,1-dioxothian-4-amine
CID 60941990

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine?
The IUPAC name of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine (CID 103625271) is N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine.
What is the SMILES notation for N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine?
The canonical SMILES for N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine is Cc1ncc(CNC2CCN(c3ccccc3)CC2)s1.
What is the InChIKey of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine?
The InChIKey is ZYPGMSXAHMZTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3S/c1-13-17-11-16(20-13)12-18-14-7-9-19(10-8-14)15-5-3-2-4-6-15/h2-6,11,14,18H,7-10,12H2,1H3.
What are the key properties of N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine?
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine has a molecular weight of 287.43 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine is sourced from PubChem (CID 103625271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).