N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine

C14H25N3S — CID 106632450

IUPACN-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine
SMILESCCN(CCc1scnc1C)CC1CCCCN1
InChIInChI=1S/C14H25N3S/c1-3-17(10-13-6-4-5-8-15-13)9-7-14-12(2)16-11-18-14/h11,13,15H,3-10H2,1-2H3
InChIKeyKWRMPLNBRRGUCH-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.46
Rot. Bonds6

About N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine

N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 106632450) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID106632450
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC NameN-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine
SMILESCCN(CCc1scnc1C)CC1CCCCN1
InChIInChI=1S/C14H25N3S/c1-3-17(10-13-6-4-5-8-15-13)9-7-14-12(2)16-11-18-14/h11,13,15H,3-10H2,1-2H3
InChIKeyKWRMPLNBRRGUCH-UHFFFAOYSA-N
XLogP2.46
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-methyl-1,3-thiazol-5-yl)methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106603544
4-methyl-5-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 130167048
2-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106605468
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
N-(azepan-2-ylmethyl)-N-ethylethanamine
CID 4715268
N-ethyl-2-(4-fluorophenoxy)-N-(piperidin-2-ylmethyl)ethanamine
CID 106632404
N-ethyl-N-(pyrrolidin-2-ylmethyl)-2-thiophen-3-ylethanamine
CID 106615069
N-methyl-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-1-[2-[(2R)-piperidin-2-yl]ethyl]triazole-4-carboxamide
CID 95875073
N-ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 4715267
N-(piperidin-2-ylmethyl)-N-(1,3-thiazol-2-ylmethyl)propan-1-amine
CID 106623603
2-ethoxy-N-ethyl-N-(piperidin-2-ylmethyl)ethanamine
CID 63696688
N-(cyclopropylmethyl)-N-(piperidin-2-ylmethyl)ethanamine
CID 63955583

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine (CID 106632450) is N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine is CCN(CCc1scnc1C)CC1CCCCN1.
What is the InChIKey of N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is KWRMPLNBRRGUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-3-17(10-13-6-4-5-8-15-13)9-7-14-12(2)16-11-18-14/h11,13,15H,3-10H2,1-2H3.
What are the key properties of N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine?
N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 267.44 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106632450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).