1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine

C15H23N5S — CID 61445305

IUPAC1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
SMILESCNCc1c(N2CCN(CC3CC3)CC2)nc2sccn12
InChIInChI=1S/C15H23N5S/c1-16-10-13-14(17-15-20(13)8-9-21-15)19-6-4-18(5-7-19)11-12-2-3-12/h8-9,12,16H,2-7,10-11H2,1H3
InChIKeyFGPFYKDIZMHTRO-UHFFFAOYSA-N
MW305.45 g/mol
LogP1.65
Rot. Bonds5

About 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine

1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine (PubChem CID 61445305) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
PubChem CID61445305
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
SMILESCNCc1c(N2CCN(CC3CC3)CC2)nc2sccn12
InChIInChI=1S/C15H23N5S/c1-16-10-13-14(17-15-20(13)8-9-21-15)19-6-4-18(5-7-19)11-12-2-3-12/h8-9,12,16H,2-7,10-11H2,1H3
InChIKeyFGPFYKDIZMHTRO-UHFFFAOYSA-N
XLogP1.65
TPSA35.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine?
The IUPAC name of 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine (CID 61445305) is 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine?
The canonical SMILES for 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine is CNCc1c(N2CCN(CC3CC3)CC2)nc2sccn12.
What is the InChIKey of 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine?
The InChIKey is FGPFYKDIZMHTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-16-10-13-14(17-15-20(13)8-9-21-15)19-6-4-18(5-7-19)11-12-2-3-12/h8-9,12,16H,2-7,10-11H2,1H3.
What are the key properties of 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine?
1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine has a molecular weight of 305.45 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine is sourced from PubChem (CID 61445305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).