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

C15H25N3S — CID 79545327

IUPACN-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESCc1ncsc1CNC1CCCC1C1CCCCN1
InChIInChI=1S/C15H25N3S/c1-11-15(19-10-18-11)9-17-14-7-4-5-12(14)13-6-2-3-8-16-13/h10,12-14,16-17H,2-9H2,1H3
InChIKeyVZALLHFSFUBBLM-UHFFFAOYSA-N
MW279.45 g/mol
LogP2.85
Rot. Bonds4

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

N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine (PubChem CID 79545327) has the molecular formula C15H25N3S and a molecular weight of 279.45 g/mol. Its IUPAC name is N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
PubChem CID79545327
Molecular FormulaC15H25N3S
Molecular Weight279.45 g/mol
Exact Mass279.18
IUPAC NameN-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESCc1ncsc1CNC1CCCC1C1CCCCN1
InChIInChI=1S/C15H25N3S/c1-11-15(19-10-18-11)9-17-14-7-4-5-12(14)13-6-2-3-8-16-13/h10,12-14,16-17H,2-9H2,1H3
InChIKeyVZALLHFSFUBBLM-UHFFFAOYSA-N
XLogP2.85
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.45
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine (CID 79545327) is N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine is Cc1ncsc1CNC1CCCC1C1CCCCN1.
What is the InChIKey of N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
The InChIKey is VZALLHFSFUBBLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3S/c1-11-15(19-10-18-11)9-17-14-7-4-5-12(14)13-6-2-3-8-16-13/h10,12-14,16-17H,2-9H2,1H3.
What are the key properties of N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine has a molecular weight of 279.45 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 79545327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).