4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine

C20H29N5O — CID 131668896

IUPAC4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine
SMILESCN1CCN(CC2CC2)C(c2cn3c(N4CCOCC4)cccc3n2)C1
InChIInChI=1S/C20H29N5O/c1-22-7-8-24(13-16-5-6-16)18(15-22)17-14-25-19(21-17)3-2-4-20(25)23-9-11-26-12-10-23/h2-4,14,16,18H,5-13,15H2,1H3
InChIKeySZQFMHVGHJACRT-UHFFFAOYSA-N
MW355.49 g/mol
LogP1.87
Rot. Bonds4

About 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine

4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine (PubChem CID 131668896) has the molecular formula C20H29N5O and a molecular weight of 355.49 g/mol. Its IUPAC name is 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine.

Molecular Properties

Compound Name4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine
PubChem CID131668896
Molecular FormulaC20H29N5O
Molecular Weight355.49 g/mol
Exact Mass355.24
IUPAC Name4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine
SMILESCN1CCN(CC2CC2)C(c2cn3c(N4CCOCC4)cccc3n2)C1
InChIInChI=1S/C20H29N5O/c1-22-7-8-24(13-16-5-6-16)18(15-22)17-14-25-19(21-17)3-2-4-20(25)23-9-11-26-12-10-23/h2-4,14,16,18H,5-13,15H2,1H3
InChIKeySZQFMHVGHJACRT-UHFFFAOYSA-N
XLogP1.87
TPSA36.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.49
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine?
The IUPAC name of 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine (CID 131668896) is 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine.
What is the SMILES notation for 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine?
The canonical SMILES for 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine is CN1CCN(CC2CC2)C(c2cn3c(N4CCOCC4)cccc3n2)C1.
What is the InChIKey of 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine?
The InChIKey is SZQFMHVGHJACRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5O/c1-22-7-8-24(13-16-5-6-16)18(15-22)17-14-25-19(21-17)3-2-4-20(25)23-9-11-26-12-10-23/h2-4,14,16,18H,5-13,15H2,1H3.
What are the key properties of 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine?
4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine has a molecular weight of 355.49 g/mol, XLogP of 1.87, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-(cyclopropylmethyl)-4-methylpiperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine is sourced from PubChem (CID 131668896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).